02 Methods for Structure Determination 9. Liquid Structure Determination X-ray Scattering Measurements of Liquid Water Authors: L. Fu, S. Brennan, A. Bienenstock Keywords: liquid, synchrotron X-ray diffraction, water structure Poster Session: 29 Board:
1 Page in the Book of Abstracts: C155 Download Abstract 02 Methods for Structure Determination 12. Ab initio Powder Diffraction Solutions: Inorganic Compounds Preparation and Crystal Structure of Tetraperoxo Complexes Authors: M. Grzywa, W. Lasocha Keywords: peroxo compounds, powder diffraction, Rietveld refinement Poster Session: 29 Board:
2 Page in the Book of Abstracts: C158 Download Abstract Space Group Determination by EXPO2005 Authors: C. Cuocci, A. G. Moliterni, A. Altomare, I. da Silva, R. Caliandro, M. Camalli, C. Giacovazzo, R. Rizzi Keywords: space groups , powder diffraction, computational crystallography Poster Session: 29 Board:
3 Page in the Book of Abstracts: C158 Download Abstract Algorithms for Solving Crystal Structure Using Texture Authors: L. Lutterotti, M. Bortolotti Keywords: structural determination, texture, Rietveld analysis Poster Session: 29 Board:
5 Page in the Book of Abstracts: C158 Download Abstract 03 Computers in Analysis, Molecular Modelling and Molecular Design 7. Structure Simulations: Protein Folding Studies 3d Model of Ternary Complex of Human 3β-HSD type I. Rational Mutagenesis. Authors: V. Pletnev, J. Thomas, W. Duax Keywords: three dimensional model, structure function relationship, mutagenesis Poster Session: 29 Board:
6 Page in the Book of Abstracts: C167 Download Abstract Force Field Parameters for the Photosystem II Reaction Center Authors: M. Kuty, P. Palencar, F. Vacha Keywords: force fields, molecular dynamics simulations, photosystem II Poster Session: 29 Board:
7 Page in the Book of Abstracts: C167 Download Abstract 03 Computers in Analysis, Molecular Modelling and Molecular Design 8. Map Fitting and Modification MAIN 2004: Model Building beyond 100 Residues per Minute. Authors: D. Turk Keywords: computational methods, software, macromolecular crystallography Poster Session: 29 Board:
8 Page in the Book of Abstracts: C167 Download Abstract Automated de novo Electron Density Map Tracing for the Structural Genomics Era Authors: D. Risal Keywords: de novo map tracing, software, automation Poster Session: 29 Board:
9 Page in the Book of Abstracts: C168 Download Abstract 03 Computers in Analysis, Molecular Modelling and Molecular Design 10. Homology Modelling, Structural Families and Doc Elucidation of Structural Models of Formyl Peptide Receptors, FPR & FPR2, and Identification of Features, Responsible for their Differential Ligand-Binding Affinities Authors: R. Rathore, T. Narasimhamurhty Keywords: homology modelling of proteins, protein structure prediction, G protein coupled receptor Poster Session: 29 Board:
10 Page in the Book of Abstracts: C168 Download Abstract Structural and Docking Studies of β-lapachone Derivatives Authors: I. Caracelli, J. Zukerman-Schpector, C. A. Brandt Keywords: docking, drug receptor modelling, stereochemistry Poster Session: 29 Board:
11 Page in the Book of Abstracts: C168 Download Abstract Homology Modeling of Xanthomonas Citri Molybdate-binding Protein Authors: A. Moutran, A. Balan, C. S. Perez, L. C. S. Ferreira, R. C. C. Ferreira, G. Neshich Keywords: ModA , ABC transporter system, molecular modelling Poster Session: 29 Board:
12 Page in the Book of Abstracts: C168 Download Abstract Specificities of Binding of Different Inhibitors of Cathepsins Authors: A. Seal, M. Dey, T. Chatterjee Keywords: thiol protease, cathepsin, stefins Poster Session: 29 Board:
13 Page in the Book of Abstracts: C169 Download Abstract 03 Computers in Analysis, Molecular Modelling and Molecular Design 11. Use Of Genetic Algorithms and Other Optimisation Methods Multi-component Analysis of Raw Diffraction Data Authors: Z. Otwinowski, D. Borek, W. Minor Keywords: macromolecular crystallography, diffraction, radiation damage Poster Session: 29 Board:
14 Page in the Book of Abstracts: C169 Download Abstract 04 Crystallography of Biological Macromolecules 3. Metallo-Enzymes Novel Mechanisms of pH Sensitivity in Tuna Hemoglobin Authors: T. Yokoyama, K. T. Chong, M. Watanabe, D. T.-B. Shih, J. R. H. Tame, S.-Y. Park Keywords: crystallography macromolecular, hemoglobins, structure and function Poster Session: 29 Board:
15 Page in the Book of Abstracts: C208 Download Abstract Substrate Specificity of Three New Intradiol Dioxygenases: an X-ray Characterization Authors: M. Ferraroni, M. P. Kolomytseva, V. M. Travkin, A. Scozzafava, L. Golovleva, F. Briganti Keywords: enzyme specificity, metalloenzymes, non heme iron protein Poster Session: 29 Board:
16 Page in the Book of Abstracts: C209 Download Abstract Crystal Structure of Iron Superoxide Dismutase from Obligate Anaerobic Bacterium Authors: Y. Kitagawa, Y. Kitagawa, I. Sekiya, M. Kitamura, T. Nakanishi, K. T. Nakamura Keywords: superoxide dismutase, iron, crystal structure Poster Session: 29 Board:
17 Page in the Book of Abstracts: C209 Download Abstract Understanding How the Alzheimer’s Amyloid Presursor Protein Binds Copper Ions Authors: G. K.-W. Kong, W. J. Mc Kinstry, J. J. Adams, D. Galatis, C. L. Masters, K. J. Barnham, R. Cappai, M. W. Parker Keywords: macromolecular crystallography, metal ions in biology, Alzheimer's proteins Poster Session: 29 Board:
18 Page in the Book of Abstracts: C209 Download Abstract Dioxygen Activation in Hansenula polymorpha Amine Oxidase Authors: B. Johnson, A. Pearson, N. Samuels, J. Klinman, C. Wilmot Keywords: copper, oxygen, activation Poster Session: 29 Board:
19 Page in the Book of Abstracts: C209 Download Abstract Analysis of Mutants of an Active Site Base in a Non-heme Extradiol Dioxygenase Authors: R. Hoeft, S. L Groce, J. D. Lipscomb, D. H Ohlendorf Keywords: enzymatic structure activity relationships, enzyme mechanism kinetics, metalloenzymes Poster Session: 29 Board:
20 Page in the Book of Abstracts: C210 Download Abstract Anion-independent Iron Binding by Campylobacter jejuni Ferric Binding Protein Authors: S. Tom-Yew, D. Cui, E. Bekker, M. Murphy Keywords: ion transport, metalloprotein, synergistic anion Poster Session: 29 Board:
21 Page in the Book of Abstracts: C210 Download Abstract Tat System of Escherichia coli: Zn2+-bound Structures of tatD, ycfH and yjjV Authors: V. Malashkevich, D. Feng, F. M. Raushel, S. C. Almo Keywords: amidohydrolases, Zn2+ enzymes, tatD Poster Session: 29 Board:
22 Page in the Book of Abstracts: C210 Download Abstract A Tri-nuclear Metal Cluster in Reduced Mouse Ribonucleotide Reductase R2 Subunit Authors: Å. K. Røhr, B. Dalhus, C. H. Gørbitz, K. K. Andersson Keywords: ribonucleotide reductase, trinuclear, diiron cluster Poster Session: 29 Board:
23 Page in the Book of Abstracts: C211 Download Abstract Structural Analysis of the Interaction between Plant Sulfite Reductase and Ferredoxin Authors: T. Saitoh, H. Toyota, M. Nakayama, T. Ikegami, G. Kurisu, M. Kusunoki, T. Hase Keywords: iron sulfur protein, protein interaction, NMR Poster Session: 29 Board:
24 Page in the Book of Abstracts: C211 Download Abstract Rv0805: Cyclic Nucleotide Phosphodiesterase from M. tuberculosis Authors: M. Podobnik, A. R. Shenoy, M. Kova?evi?, S. S. Visweswariah Keywords: cyclic nucleotides, phosphodiesterase, metalloenzymes Poster Session: 29 Board:
25 Page in the Book of Abstracts: C211 Download Abstract Manganese Superoxide Dismutases and Substrate Mimic Derivatives Authors: S. H. Oakley, J. R. Salvador, B. F. Anderson, D. Cabelli, M. M. Whittaker, J. W. Whittaker, G. B. Jameson Keywords: metalloenzymes, superoxide dismutase, azide Poster Session: 29 Board:
26 Page in the Book of Abstracts: C211 Download Abstract Dynamic Structures and Reaction Mechanism of Active Fe-type Nitrile Hydratase. Authors: Y. Kawano, K. Hashimoto, N. Kamiya Keywords: nitrile hydratase, cysteine sulfenate, dynamic structure Poster Session: 29 Board:
27 Page in the Book of Abstracts: C212 Download Abstract Structural Studies on Cerebratulus lacteus Mini-Hb K(E10)W and L(G12)A Mutants Authors: M. Nardini, A. Pesce, S. Dewilde, L. Moens, M. Bolognesi Keywords: hemoglobins, mutagenesis, Xe binding Poster Session: 29 Board:
28 Page in the Book of Abstracts: C212 Download Abstract Structure of the MntC Protein: Mn2+ Import in Cyanobacteria is Redox Controlled Authors: N. Adir, V. Rukhman, M. Melamed-Frank, R. Anati Keywords: ABC transporter system, photosynthesis, redox control Poster Session: 29 Board:
29 Page in the Book of Abstracts: C212 Download Abstract Crystal Structure of Eukaryotic FeSODs Suggests Intersubunit Cooperation during Catalysis Authors: I. Muñoz, J. F. Moran, M. Becana, G. Montoya Keywords: crystal structure, metalloenzymes, FeSOD Poster Session: 29 Board:
30 Page in the Book of Abstracts: C212 Download Abstract Towards the Crystal Structure of Saccharomyces cerevisiae Frataxin Authors: T. Karlberg, O. Gakh, I. Grazia, S. Al-Karadaghi Keywords: iron storage, heme synthesis, X-ray crystal structure Poster Session: 29 Board:
31 Page in the Book of Abstracts: C213 Download Abstract The Crystal Structure of NEP and its Complexes with Inhibitors Authors: P. Grochulski, L. Gonneville, J. Sygusch Keywords: macromolecular synchrotron crystallography, metalloprotein, enzyme inhibitors Poster Session: 29 Board:
32 Page in the Book of Abstracts: C213 Download Abstract Crystal Structures of Cyanobacterial Heme Oxygenases Authors: M. Sugishima, Y. Hagiwara, C. T. Migita, X. Zhang, T. Yoshida, K. Fukuyama Keywords: heme protein, oxygenase, redox proteins Poster Session: 29 Board:
33 Page in the Book of Abstracts: C213 Download Abstract Crystal Structure of Nitrile Hydratases: Possible Industrial Usage Authors: A. O. Tastan Bishop, T. Tsekoa, T. Sewell, R. Cameron, M. Sayed, D. Cowan Keywords: model building, enzyme active site, metalloenzymes Poster Session: 29 Board:
34 Page in the Book of Abstracts: C213 Download Abstract Crystal Structure and Stability of Red Alga Porphyra yezoensis Cytochrome c6 Authors: H. Chida, S. Yamada, H. Shimizu, T. Satoh, H. Akazaki, T. Yokoyama, Y. Takayama, R. Kawachi, S. Y. Park, T. Nishio, T. Oku Keywords: cytochromes, mutagenesis, structural stability Poster Session: 29 Board:
35 Page in the Book of Abstracts: C214 Download Abstract Structure of the Intermediates in the Myoglobin-peroxide Reaction Authors: H.-P. Hersleth, T. Uchida, T. Teschner, Å. K. Røhr, V. Schünemann, K. Nilsson, Y. Hsiao, T. H. Rod, A. X. Trautwein, U. Ryde, T. Kitagawa, C. H. Görbitz, K. K. Andersson Keywords: metalloprotein, crystallography, spectroscopy Poster Session: 29 Board:
36 Page in the Book of Abstracts: C214 Download Abstract Crystal Structure of PA0740, a Novel Zinc Hydrolase of Pseudomonas aeruginosa Authors: G. Hagelüken, T. Adams, L. Wiehlmann, H. Kolmar, D. W. Heinz, W.-D. Schubert Keywords: Pseudomonas aeruginosa, quorum sensing, zinc hydrolase Poster Session: 29 Board:
37 Page in the Book of Abstracts: C214 Download Abstract Mimicking Evolution from Inactive Bacillus subtilis SOD-like Protein to Active Mutants Authors: V. Calderone, L. Banci, M. Benvenuti, I. Bertini, A. Fantoni, S. Mangani, M. Migliardi, M. S. Viezzoli, D. E. Cabelli Keywords: Bacillus subtilis SOD, Cu Zn SOD, SOD mutants Poster Session: 29 Board:
38 Page in the Book of Abstracts: C214 Download Abstract Structural Characterization of the Oxidation Pathway of Antarctic Fish Hemoglobins Authors: L. Vitagliano, G. Bonomi, M. Franzese, A. Merlino, A. Vergara, C. Verde, G. di Prisco, L. Mazzarella Keywords: hemoglobins, protein oxidation, protein cooperativity Poster Session: 29 Board:
39 Page in the Book of Abstracts: C215 Download Abstract Crystal Structure of Human Indoleamine 2,3-dioxygenase Authors: H. Sugimoto, S. Oda, T. Otsuki, T. Yoshida, Y. Shiro Keywords: heme protein, oxygenase, metalloenzymes Poster Session: 29 Board:
40 Page in the Book of Abstracts: C215 Download Abstract High Resolution Structure of Cytoglobin Reveals the Extra Helix in N-terminus Authors: M. Makino, H. Sugimoto, H. Sawai, N. Kawada, K. Yoshizato, Y. Shiro Keywords: heme, cytoglobin, myoglobin Poster Session: 29 Board:
41 Page in the Book of Abstracts: C215 Download Abstract The Crystal Structure of the (Zn/Zn)bLAP/Zofenoprilat Complex Authors: V. Alterio, M. Cappiello, P. Amodeo, A. Scaloni, A. Del Corso, C. Pedone, U. Mura, G. De Simone Keywords: protein biocrystallography, protein inhibitor complex, metalloenzymes Poster Session: 29 Board:
42 Page in the Book of Abstracts: C215 Download Abstract The Crystal Structure of Human CA II Bound to a Strong Benzenesulfonamide Inhibitor Authors: A. Di Fiore, G. De Simone, V. Menchise, C. Pedone, A. Casini, A. Scozzafava, C. T. Supuran Keywords: protein biocrystallography, protein inhibitor complex, rational inhibitor design Poster Session: 29 Board:
43 Page in the Book of Abstracts: C216 Download Abstract Role of the Non-protein Ligand at the Ni-Fe Active Site of [NiFe] Hydrogenase Authors: Y. Higuchi, H. Ogata, S. Hirota, A. Nakahara, H. Komori, N. Shibata Keywords: Ni Fe hydrogenase, NiA and NiB, non protein ligand Poster Session: 29 Board:
44 Page in the Book of Abstracts: C216 Download Abstract Crystal Structure of Mouse Carnosinase CN2 at 1.8 Å Resolution Authors: M. Kusunoki, H. Unno, T. Yamashita, S. Ujita, N. Okumura, H. Otani, A. Okumura, K. Nagai Keywords: metalloproteinases, enzyme active site, protein structure determination Poster Session: 29 Board:
45 Page in the Book of Abstracts: C216 Download Abstract Class III Superoxide Reductase from Treponema pallidum Authors: T. Santos-Silva Keywords: superoxide, soft X-rays, iron Poster Session: 29 Board:
46 Page in the Book of Abstracts: C216 Download Abstract Crystal Structures of Cytochrome c Peroxidases from Ps. nautica and Ps. stutzeri Authors: C. Bonifácio, J. M. Dias, J. Trincão, T. Alves, C. G. Timóteo, I. Moura, M. Romão Keywords: peroxidases, heme, calcium activation Poster Session: 29 Board:
47 Page in the Book of Abstracts: C216 Download Abstract Structures of Matrix Metalloproteinase - 9 in Complex with Pharmacological Inhibitors Authors: A. Tochowicz, P. Goettig, W. Bode, K. Maskos Keywords: matrix metalloproteinase 9 (MMP9), inhibitors, structure Poster Session: 29 Board:
48 Page in the Book of Abstracts: C217 Download Abstract Ru(bpy)2(mbpy)-Adx(1-108) Complex: Photoreduction and Crystal Structure Authors: A. Halavaty, J. J. Müller, U. Heinemann Keywords: metallo-enzymes, electron transfer, crystal structure Poster Session: 29 Board:
49 Page in the Book of Abstracts: C217 Download Abstract 04 Crystallography of Biological Macromolecules 12. Receptor and Signal Transduction Proteins Structure of MRG15 Reveals a Novel Fold and Provides Insights into its Biological Functions Authors: P. Zhang, Y. Liu, J. Du, J. D. Key Keywords: MRG15, novel fold, chromo domain Poster Session: 29 Board:
50 Page in the Book of Abstracts: C231 Download Abstract Crystal Structure of the Small G Protein M-Ras and Its Implications Authors: S. Muraoka, M. Yamamoto, N. Yagi, T. Ueki, M. Ye, F. Shima, J. Liao, H. Okamoto, A. Tamura, T. Kataoka Keywords: Ras, switch region, crystal structure Poster Session: 29 Board:
51 Page in the Book of Abstracts: C231 Download Abstract Structural Studies of Plant RKIP/PEBP Family Members Authors: M. Booth, D. Miller, L. Brady Keywords: signal transduction, kinase regulation, RKIP/PEBP Poster Session: 29 Board:
52 Page in the Book of Abstracts: C231 Download Abstract Inwardly Rectifying Potassium Channels Authors: O. Sleator, S. Prince Keywords: Kir, potassium channels, membrane protein Poster Session: 29 Board:
53 Page in the Book of Abstracts: C231 Download Abstract Structural and Functional Analysis of SHPS-1, a Receptor-type Membrane Protein Authors: A. Nagata, A. Nakagawa Keywords: SHPS-1, CD47, intercellular communication Poster Session: 29 Board:
54 Page in the Book of Abstracts: C232 Download Abstract Interaction retween Raf Kinase and Raf Kinase Inhibitor Protein Authors: N. Burton, P. Simister, R. L. Brady Keywords: signal transduction proteins, macromolecular crystallography, ligand protein interactions Poster Session: 29 Board:
55 Page in the Book of Abstracts: C232 Download Abstract Structural Studies of Mycobacterial Protein Kinases and Phosphatases Authors: A. Wehenkel, A. Villarino, P. Fernandez, M. Bellinzoni, P. England, P. M. Alzari Keywords: mycobacteria, signal transduction proteins, protein interaction Poster Session: 29 Board:
56 Page in the Book of Abstracts: C232 Download Abstract Banana Lectin, a β-prism I Fold Lectin with Two Carbohydrate-binding Sites Authors: M. Vijayan, K. Saikrishnan, P. Kumar, Z. Dauter, K. Sekar, A. Surolia, D. D. Singh Keywords: lectin, β prism I fold , protein carbohydrate interaction Poster Session: 29 Board:
57 Page in the Book of Abstracts: C232 Download Abstract Crystal Structure of the HGF β-chain in Complex with the Sema Domain of the Met Receptor Authors: C. Wiesmann, J. Stamos Keywords: hepatocyte growth factor, met receptor, sema domain Poster Session: 29 Board:
58 Page in the Book of Abstracts: C233 Download Abstract Crystal Structure of Human C-type Lectin-like Oxidized LDL Receptor 1(LOX-1) Authors: T. Ishigaki, I. Ohki, T. Oyama, S. Machida, S. Tate, K. Morikawa Keywords: atherosclerosis, membrane receptors, three dimensional protein structure Poster Session: 29 Board:
59 Page in the Book of Abstracts: C233 Download Abstract The ‘Active-like’ Structure of the Unphosphorylated Response Regulator StyR Authors: M. Milani, L. Leoni, G. Rampioni, E. Zennaro, P. Ascenzi, M. Bolognesi Keywords: two component signal transduction, response regulator, phosphorylation Poster Session: 29 Board:
60 Page in the Book of Abstracts: C233 Download Abstract Insecticide Selectivity: Structure of a Hemipteran Ecdysone Receptor LBD Authors: M. Lawrence, J. A. Carmichael, L. D. Graham, P. A. Pilling, V. Chandana Epa, G. Lovrecz, G. N. Hannan, R. J. Hill Keywords: insecticides, nuclear receptors, ecdysone Poster Session: 29 Board:
61 Page in the Book of Abstracts: C233 Download Abstract Structural Basis for Autoinhibition and Activation of eIF2α Protein Kinase GCN2 Authors: A. K. Padyana, H. Qiu, A. Roll-Mecak, A. G. Hinnebusch, S. K. Burley Keywords: translation regulator, signal transduction, protein kinases Poster Session: 29 Board:
62 Page in the Book of Abstracts: C233 Download Abstract Domain Closure of the Ligand-binding Core of the AMPA Receptor GluR2: Insights from Agonist and Antagonist Complexes Authors: C. Kasper, K. Frydenvang, B. Vestergaard, D. Sprogøe, H. Hald, L. Brehm, M. Gajhede, J. Sandholm Kastrup Keywords: neurotransmission, receptor ligand interactions, X-ray crystallography of proteins Poster Session: 29 Board:
63 Page in the Book of Abstracts: C234 Download Abstract Structural Studies of Kainate Receptor GluR5 Ligand-binding Core Complexes Authors: J. S. Kastrup, P. Naur, B. Vestergaard, L. K. Skov, J. Egebjerg, M. Gajhede Keywords: neurotransmission, receptor ligand interactions, X-ray crystallography of proteins Poster Session: 29 Board:
64 Page in the Book of Abstracts: C234 Download Abstract Unraveling the Binding Mode of the Neutralizing Neuroantibody aD11 to NGF Authors: S. Covaceuszach, A. Cassetta, A. Cattaneo, D. Lamba Keywords: antibody antigen interactions, antibody structure function, neurotrophin Poster Session: 29 Board:
65 Page in the Book of Abstracts: C234 Download Abstract Towards a Comprehension of the Structure of Mouse proNGF Authors: F. Paoletti, S. Covaceuszach, E. Schwarz, M. Stubbs, R. Rudolph, A. Cattaneo, D. Lamba Keywords: neurotrophin, protein refolding, biophysical and biochemical characterization Poster Session: 29 Board:
66 Page in the Book of Abstracts: C234 Download Abstract Structural Basis for the Activity and Allosteric Control of Diguanylate Cyclase Authors: C. Chan, R. Paul, D. Samoray, N. Amiot, B. Giese, U. Jenal, T. Schirmer Keywords: response regulator, cyclic dinucleotide, allosteric control Poster Session: 29 Board:
67 Page in the Book of Abstracts: C235 Download Abstract 04 Crystallography of Biological Macromolecules 16. Multi-domain Proteins Crystal structure of the Actinomadura R39 DD-peptidase (PBP4) Authors: E. Sauvage, P. Charlier Keywords: peptidoglycan biosynthesis, carboxypeptidase, penicillin-binding protein Poster Session: 29 Board:
68 Page in the Book of Abstracts: C249 Download Abstract Sulfur SAD Structure of Heparin-Binding CRISP from Naja atra Reveals Protease and Ion Channel Blocking Domains Authors: C.-J. Chen, Y.-L. Wang, S.-C. Lee, K.-S. Goh, W.-N. Huang, W. Wu Keywords: sulfur SAD phasing, toxin CRISP structure, heparin Poster Session: 29 Board:
69 Page in the Book of Abstracts: C249 Download Abstract Structure of Parasporin-1, a Novel Bacterial Cytotoxin against Human Cancer Cells Authors: T. Akiba, T. Ichimatsu, H. Katayama, T. Akao, O. Nakamura, E. Mizuki, M. Ohba, K. Harata Keywords: pore-forming toxins, anticancer biochemistry, receptor recognition Poster Session: 29 Board:
70 Page in the Book of Abstracts: C250 Download Abstract Structure of Diol Dehydratase Reactivating Factor – A Novel Molecular Chaperone Authors: N. Shibata, K. Mori, N. Hieda, M. Yamanishi, Y. Higuchi, T. Toraya Keywords: diol dehydratase reactiving factor, molecular chaperone, crystal structure Poster Session: 29 Board:
71 Page in the Book of Abstracts: C250 Download Abstract Structural and Functional Analysis of PDI–related Proteins Authors: M. Sevvana, Q. Ma, K. Barnewitz, C. Guo, H.-D. Söling, D. M. Ferrari, G. M. Sheldrick Keywords: chaperone, protein disulfide isomerase, Wind Poster Session: 29 Board:
72 Page in the Book of Abstracts: C250 Download Abstract TPR Repeat Domain of O-linked GlcNAc Transferase: Similarities to Importin Alpha Authors: M. Jinek, J. Rehwinkel, B. Lazarus, E. Izaurralde, J. A. Hanover, E. Conti Keywords: glycosylation, TPR repeat, protein-protein interactions Poster Session: 29 Board:
73 Page in the Book of Abstracts: C250 Download Abstract Structural Studies of Quinolinate Synthase Authors: E. Soriano, E. Settembre, T. P. Begley, S. E. Ealick Keywords: quinolinate synthase, NAD biosynthesis, quinolinate Poster Session: 29 Board:
74 Page in the Book of Abstracts: C251 Download Abstract A Second FMN-binding Site in Yeast CPR Suggests a Novel Mechanism of Electron Transfer by Diflavin Reductases Authors: L. M. Podust, M. R. Waterman Keywords: diflavin reductase, electron transfert, FMN-binding Poster Session: 29 Board:
75 Page in the Book of Abstracts: C251 Download Abstract Identification and Purification of a Soluble Region of BubR1 Authors: D. Han, J. Yoon, Y. Kang, K. Kim, J. Park, Y. Kim Keywords: protein secondary structure analysis, cell-cycle protein, solubility Poster Session: 29 Board:
76 Page in the Book of Abstracts: C251 Download Abstract 04 Crystallography of Biological Macromolecules 19. Diseases and Toxicity Crystal Structure of Decameric Peroxiredoxin (AhpC) from Amphibacillus xylanus Authors: K. Kitano, A. Kita, T. Hakoshima, Y. Niimura, K. Miki Keywords: protein structures, antioxidants, oligomers Poster Session: 29 Board:
77 Page in the Book of Abstracts: C252 Download Abstract Structures of CFTR NBD1 Suggest a Molecular Mechanism for Cystic Fibrosis Authors: H. Lewis Keywords: disease related structures, cystic fibrosis, nucleotide binding domain Poster Session: 29 Board:
78 Page in the Book of Abstracts: C253 Download Abstract Amyloidosis:Structure of a λ 6 Light Chain Antibody Fragment. Authors: E. Horjales, P. Gonzalezrrubio-Garrido, E. Rudiño-Piñera, B. Becerril, L. Del Pozo Keywords: amyloidosis, fibres, crystallographic structure Poster Session: 29 Board:
79 Page in the Book of Abstracts: C253 Download Abstract Structural and Functional Study of the Bloom Syndrome Protein Authors: P. Rigolet, S. Guo, X. G. Xi Keywords: cancer, DNA-protein interactions, structure-function Poster Session: 29 Board:
80 Page in the Book of Abstracts: C253 Download Abstract Molecular Basis for Antitumor Effect of Actin-aplyronine A Complex Authors: K. Hirata, S. Muraoka, K. Suenaga, H. Tanaka, M. Yamamoto, M. Takata, H. Kigoshi Keywords: aplyronine A, antitumor, maximum entropy method Poster Session: 29 Board:
81 Page in the Book of Abstracts: C253 Download Abstract Crystal Structure of SSL11, a Superantigen-related Toxin from Staphylococcus aureus Authors: H. M. Baker, M. Chung, J. D. Fraser, E. N. Baker Keywords: bacterial toxin, crystal structure, dimerisation Poster Session: 29 Board:
82 Page in the Book of Abstracts: C254 Download Abstract Crystal Structure of 5-Aminolevulinate Synthase of Rhodobacter capsulatus Authors: J. Schulze, I. Astner, D. Jahn, W.-D. Schubert, D. W. Heinz Keywords: heme biosynthesis, pyridoxal 5’-phosphate, anemia Poster Session: 29 Board:
83 Page in the Book of Abstracts: C254 Download Abstract Structures of B. burgdorferi OspB Alone, and in Complex with a Bactericidal Fab Authors: M. Becker, J. Bunikis, B. D. Lade, J. J. Dunn, A. G. Barbour, C. L. Lawson Keywords: Lyme disease, antibody antigen interactions, cell surfaces Poster Session: 29 Board:
84 Page in the Book of Abstracts: C254 Download Abstract Crystal Structure of Botulinum Neurotoxin Type G Light Chain Authors: J. Arndt, W. Yu, F. Bi, R. C. Stevens Keywords: botulinum neurotoxin, light chain, substrate recognition Poster Session: 29 Board:
85 Page in the Book of Abstracts: C254 Download Abstract 04 Crystallography of Biological Macromolecules 23. High Resolution Protein Structures Structural Insights into GnT-I Substrate Recognition & Specificity Authors: R. Gordon, P. Sivarajah, M. Satkunarajah, D. Ma, D. Vizitiu, C. A. Tarling, S. G. Withers, J. M. Rini Keywords: glycosyltransferases, enzyme ligand complexes, active-site recognition Poster Session: 29 Board:
86 Page in the Book of Abstracts: C260 Download Abstract On the Incompleteness of Atomic Models Authors: A. Urzhumtsev, P. Afonine, V. Y. Lunin Keywords: modelling of proteins,statistical methods, high resolution Poster Session: 29 Board:
87 Page in the Book of Abstracts: C260 Download Abstract Ultra-high Resolution Measurement at BL41XU of SPring-8 Authors: N. Shimizu, M. Kawamoto, K. Hasegawa, H. Sakai, A. Nisawa, T. Shimizu, T. Nakatsu, H. Katoh, M. Yamamoto Keywords: very high resolution structure, crystallography instrumentation, synchrotron radiation Poster Session: 29 Board:
88 Page in the Book of Abstracts: C260 Download Abstract A Challenge to Bonding Nature Study in Protein Crystallography Authors: M. Takata, K. Hirata, H. Tanaka, A. Nakagawa, T. Tsukihara, K. Fukuyama, Y. Shiro Keywords: protein crystallography, maximum entropy method, bonding electron Poster Session: 29 Board:
89 Page in the Book of Abstracts: C260 Download Abstract Opening of the Safety-belt Loop of Human Aldose Reductase Authors: M. Biadene, I. Hazemann, T. R. Schneider Keywords: high resolution refinement, active-site structure, loop modelling Poster Session: 29 Board:
90 Page in the Book of Abstracts: C261 Download Abstract Crystal Structure of Caenorhabditis elegans Spermidine Synthase: in Preparation Authors: D. V. Tamu, K. Lüersen, M-L. Eschbach, H. Haider, R. D. Walter, S. Al-Karadaghi Keywords: Caenorhabditis elegans, polyamines, spermidine synthase Poster Session: 29 Board:
91 Page in the Book of Abstracts: C261 Download Abstract Structure of Ralstonia solanacearum Fucose Binding Lectin at 0.94Å Resolution Authors: E. Mitchell, N. Kostlánová, N. Gilboa-Garber, S. Oscarson, M. Wimmerová, A. Imberty Keywords: lectin crystallography, atomic resolution crystallography, synchrotron radiation crystallography Poster Session: 29 Board:
92 Page in the Book of Abstracts: C261 Download Abstract Crystal Structures of Ribosomal Protein L10 in Complex with L7/12 N-Terminal Domains Authors: M. Diaconu, M. C. Wahl Keywords: L10-L7/12 complex, L7/12 stalk, ribosome structure Poster Session: 29 Board:
93 Page in the Book of Abstracts: C261 Download Abstract 07 Crystallography of Organometallic, Co-ordination and Main Group Compounds 1. Metal Atom Complexes (N = 1-3) and Metal Clusters (N>3) Synthesis and Structure of the 1:1 Adducts of Copper (I) Halides with Bis-(benzophenone)ethylenediimine Authors: R. Kia, V. Mirkhani, S. Harkema Keywords: copper (I) complexes, Schiff base, crystal structures Poster Session: 29 Board:
94 Page in the Book of Abstracts: C295 Download Abstract Synthesis and Structural Analysis of a Number of Hexacoordinate Heteroleptic Non-VSEPR Molybdenum and Tungsten Complexes Authors: S. Ghammamy, M. Rezaee Keywords: inorganic synthesis, structural analysis, non VSEPR Poster Session: 29 Board:
95 Page in the Book of Abstracts: C295 Download Abstract Crystal and Molecular Structure of Bis-N-Octyl-hydroxy-naphthaldiminato Cu(II). A Study Including Magnetic Properties of Also N-Dodecyl and N-Octadecyl Derivatives Authors: J. Costamagna, A. Ríos-Escudero, M. Villagrán, E. Spodine, F. Caruso, J. Zagal, G. Cardenas-Jirón, M. Páez Keywords: liquid crystal, Schiff base ligands, antiferromagnetism Poster Session: 29 Board:
96 Page in the Book of Abstracts: C295 Download Abstract Silver Complexes Containing 1,3-Butadiynediide C42- and Ar(C=C-)n (n = 1, 2) Authors: L. Zhao, T. C. W. Mak Keywords: argentophilic interaction, carbides, silver compounds Poster Session: 29 Board:
97 Page in the Book of Abstracts: C295 Download Abstract Mn- and Cr-highly Electrophilic Carbenes: Calculated vs Experimental Parameters Authors: J. F. Van der Maelen Uría, S. García-Granda, J. Ruiz Keywords: ab initio and DFT calculations, organometallic compounds, electron-affinity computations Poster Session: 29 Board:
98 Page in the Book of Abstracts: C296 Download Abstract Structure of New Different-ligand Uranyl Complexes Authors: I. V. Medrish, A. V. Virovets, E. V. Peresypkina, L. B. Serezhkina Keywords: uranyl compounds, crystal structure research, X-ray analysis Poster Session: 29 Board:
99 Page in the Book of Abstracts: C296 Download Abstract Polymorphism of Yttrium Threemethilacetate Authors: E. A. Kiseleva, Y. M. Korenev, S. I. Troyanov Keywords: yttrium threemethilacetate, polymorphism, molecular structure Poster Session: 29 Board:
100 Page in the Book of Abstracts: C296 Download Abstract Unconventional Distribution of Hydrides in Hydrido Rhenium Carbonyl Clusters Authors: G. Marinoni, M. Panigatti, G. D’ Alfonso, P. Mercandelli, A. Sironi Keywords: clusters, hydrides, structural computing Poster Session: 29 Board:
101 Page in the Book of Abstracts: C296 Download Abstract C-H•••π Interactions in the Novel Ni(II) Complex with Tetradentate Thiosemicarbazide Based Ligand Authors: B. M. Draskovic, G. A. Bogdanovic, V. M. Leovac Keywords: C-H•••π interaction, Ni (II) compounds, thiosemicarbazide Poster Session: 29 Board:
102 Page in the Book of Abstracts: C296 Download Abstract Isolation and Characterization of a Ferromagnetic Gadolinium (III) Citrate Chain Authors: R. Baggio, M. T. Garland, O. Peña, M. Perec Keywords: lanthanides, structures, ferromagnetism Poster Session: 29 Board:
103 Page in the Book of Abstracts: C297 Download Abstract Novel water-soluble Peroxo Complexes of Nb(V) and Ta(V) Authors: B. Tinant, D. Bayot, M. Devillers Keywords: niobium complexes, peroxo compounds, polyaminocarboxylate acids Poster Session: 29 Board:
104 Page in the Book of Abstracts: C297 Download Abstract Studies in the Structural Chemistry of Complexes between Nucleobases and s-Block Metals Authors: K. Guille, W. Clegg Keywords: nucleobases, s-block metals, coordination Poster Session: 29 Board:
105 Page in the Book of Abstracts: C297 Download Abstract Structure of Pd(II) Complex with a 2-(diphenylphosphino)benzaldehyde Derivative Authors: K. Andjelkovic, A. Bacchi, G. Pelizzi, V. Radulovic, I. Brceski, D. Sladic Keywords: pd(II) complex, hydrazone, PNO tridentate Poster Session: 29 Board:
106 Page in the Book of Abstracts: C297 Download Abstract From P4 to PH3 Metal Complexes by Plane Hydrolysis Authors: M. Di Vaira, P. Frediani, S. Seniori Costantini, M. Peruzzini, P. Stoppioni Keywords: phosphorus compounds, ruthenium compounds, hydrolysis Poster Session: 29 Board:
107 Page in the Book of Abstracts: C298 Download Abstract New Polymeric Barium(II)2,2'-diphenyldicarboxylate Complex Authors: F. Balegroune, S. Djehni, A. Guehria-Laidoudi, E. Wenger Keywords: 2‚2’-diphenyldicarboxylic acid, barium complexes, crystal structure Poster Session: 29 Board:
108 Page in the Book of Abstracts: C298 Download Abstract Fabrications of Carbon Nanotube Coated with Os-Pd Mixed-metal Nanoparticles Authors: W.-T. Wong, K.-F. Yung Keywords: carbon nanotube, metal cluster, osmium Poster Session: 29 Board:
109 Page in the Book of Abstracts: C298 Download Abstract Synthesis and Structural Characterization of a Series of High-hydride Content Osmium-Rhodium Carbonyl Complexes Authors: J. P. Lau, W.-T. Wong Keywords: osmium-rhodium clusters, hydride content, single crystal X-ray diffraction Poster Session: 29 Board:
110 Page in the Book of Abstracts: C298 Download Abstract Scorpionate Complexes with the Main Group Elements Ca, Ba, Sr Authors: R. Spagna, C. Santini, M. Pellei, G. Gioia Lobbia, M. Pallotta, S. Alidori, M. Camalli Keywords: metaloorganic chemistry, pyrazolyl, crystal structures Poster Session: 29 Board:
111 Page in the Book of Abstracts: C298 Download Abstract Synthesis and Crystal Structure of [Co(HL)L].CH3OH (H2L = Pyridoxal S-methylisothiosemicarbazone) Authors: V. S. Jevtovic, V. M. Leovac, G. A. Bogdanovic Keywords: cobalt(III) complex, pyridoxal S-methylisothiosemicarbazone, mer-octahedral configuration Poster Session: 29 Board:
112 Page in the Book of Abstracts: C299 Download Abstract Novel Five-membered B-N-C Heterocycles Authors: M. Parvez, K. E. Krahulic, H. V. Ly, T. D. Forster, R. Roesler Keywords: coordination complexes, heterocycles, catalysts Poster Session: 29 Board:
113 Page in the Book of Abstracts: C299 Download Abstract A new Trinuclear Europium(III) Complex Authors: Z. Xi-Rui, K. Han-Mao, H. Chun-Fang, L. Jian-Qiang Keywords: crystalline structure, rare-earth materials, pyridine complexes Poster Session: 29 Board:
114 Page in the Book of Abstracts: C299 Download Abstract Non Classical vs. Classical Metal•••H3C-C Interactions: A Neutron Diffraction Study of a 14-Electron Ruthenium(II) System Authors: E. Herdtweck, W. Baratta, S. A. Mason, C. Mealli Keywords: neutron structure determination, hydrogen bonding of coordination compounds, databases Poster Session: 29 Board:
115 Page in the Book of Abstracts: C299 Download Abstract Order-Disorder Phase Transition in Hexakis(Imidazole)Metal(II) Complex Authors: P. Martín-Zarza, C. González Silgo, S. Radescu, E. Hernández-Bocanegra, X. Solans Keywords: order-disorder, phase transition, nickel complex Poster Session: 29 Board:
116 Page in the Book of Abstracts: C300 Download Abstract Bis–(5,5’–diethylbarbiturato)copper(II) and cadmium(II) Complexes with Ethylenediamine Authors: C. Kazak, F. Yilmaz, V. T. Yilmaz Keywords: 5‚5'-diethylbarbiturate, ethylenediamine, copper(II) Poster Session: 29 Board:
117 Page in the Book of Abstracts: C300 Download Abstract Crystal Structure of N-picoloylhydrazide and its Binuclear Palladium Complex Authors: W.-S. Wu, J. Chen, L. Shi, Y. Lu Keywords: crystal structures, N-picoloylhydrazide, binuclear palladium complex Poster Session: 29 Board:
118 Page in the Book of Abstracts: C300 Download Abstract Copper-imidazole-chloride/bromide complexes Authors: N. Lah, P. Segedin, M. Jacimovic, I. Leban Keywords: copper, imidazole, coordination polymer Poster Session: 29 Board:
119 Page in the Book of Abstracts: C300 Download Abstract Bis(bis(μ2-dimethylglycine-O,O´)-tetrachlorocuprate-dicopper(II)) Hydrate Authors: M. Ramos Silva, A. Matos Beja, J. A. Paixão, J. Martín-Gil Keywords: X-ray crystallography of coordination compounds , copper coordination compounds, single crystals Poster Session: 29 Board:
120 Page in the Book of Abstracts: C300 Download Abstract Spectroscopic and Structural Investigation of ZnI2(nicotinamide)2, [Zn(H2O)2(picolinamide)2]I2 and Zn I2(isonicotinamide)2 Authors: H. Pasaoglu, S. Güven, O. Büyükgüngör Keywords: IR and XRD, zinc complexes, amides Poster Session: 29 Board:
121 Page in the Book of Abstracts: C301 Download Abstract Green-yellow Thermochromism of (N-methyl-2,6-lutidinium)2 CuCl4 Authors: M. R. Bond, A. Gerdes, A. F. Kelley Keywords: copper complexes, phase transitions, hydrogen bonding Poster Session: 29 Board:
122 Page in the Book of Abstracts: C301 Download Abstract Structure of Hydrido(carboxylato)Ir(III) Complexes and Catalytic Symmetric Hydrogenation of Imines Authors: T. Yamagata, K. Hoshida, M. Nagata, K. Mashima, K. Tani Keywords: absolute configuration, asymmetric catalysis, carboxylate complexes Poster Session: 29 Board:
123 Page in the Book of Abstracts: C301 Download Abstract Synthesis, Characterization and Crystal Structure of new Transition Metal Compounds of Thiocyanate Authors: L. Tatar Yildirim, R. Kurtaran, O. Atakol Keywords: Crystal structure, thiocyanate complexes, copper(II) and mercury(II) complexes Poster Session: 29 Board:
124 Page in the Book of Abstracts: C301 Download Abstract Crystal Structure of Trimethyltin hydroxide, (CH3)3SnOH Authors: N. Kanehisa, Y. Kai Keywords: tin, hydroxide, disorder Poster Session: 29 Board:
125 Page in the Book of Abstracts: C301 Download Abstract Crystal Structure of [RuCl(dpphen)(terpy)]PF6 and [Ru(CH3CN)(phen)(terpy)](PF6)2 Authors: N. Yoshikawa, H. Takashima, K. Tsukahara, N. Kanehisa, Y. Kai Keywords: microwave, terpyridine, ruthenium compounds Poster Session: 29 Board:
126 Page in the Book of Abstracts: C302 Download Abstract Structural Studies on Copper(II) Carboxylate Complexes Containing Pyrazole Authors: M. Monari, L. Pandolfo, C. Pettinari Keywords: copper complexes, x-ray crystal structure, carboxylate Poster Session: 29 Board:
127 Page in the Book of Abstracts: C302 Download Abstract Crystal Packing of Three-Aqua Sodium Maleate Authors: A. Kapor, S. Cakic, T. Armbruster, V. Divjakovic, B. Ribar Keywords: coordination geometry, hydrogen bonds, crystal packing Poster Session: 29 Board:
128 Page in the Book of Abstracts: C302 Download Abstract Structural Parameters of Several Lanthanide Clusters Authors: D. Swenson, C. T. Yang, D. Nolting, L. Messerle Keywords: clusters, lanthanides, materials magnetic resonance imaging Poster Session: 29 Board:
129 Page in the Book of Abstracts: C302 Download Abstract Unit Cellmates: the Cis and Trans Isomers of an Iron(II) Complex Co-crystallize Authors: K. W. Törnroos, M. Hostettler, D. Chernyshov, H.-B. Bürgi Keywords: iron (II) , isomers, co-crystallization Poster Session: 29 Board:
130 Page in the Book of Abstracts: C303 Download Abstract Influence of the R Group in [Mo2(μ-R)(μ-PCy2)(CO)2Cp2], R=H, CH3, Ph, Bz Authors: L. Marchio', M. A. Ruiz, A. Ramos, M. E. Garcia, R. Cammi, M. Lanfranchi, A. Tiripicchio Keywords: molybdenum, crystal structure, ab-initio calculations Poster Session: 29 Board:
131 Page in the Book of Abstracts: C303 Download Abstract Synthesis and X-ray Study of the P5-polyphosphorus Rhodium Complex [(dppm){Ph2PCH2P(Ph2)PPPP}Rh]OTf Authors: D. Yakhvarov, O. Sinyashin, P. Barbaro, S. Mañas, S. Midollini, A. Orlandini, M. Peruzzini, F. Zanobini Keywords: white phosphorus, Rh-compounds, P5-ligand Poster Session: 29 Board:
132 Page in the Book of Abstracts: C303 Download Abstract Structural Analysis of New Early-late Heterobimetallic Tetranuclear Metallomacrocycles Authors: M. L. Martin-Albina, I. T. Dobrinovitch, M. C. Alvarez-Vergara, J. Pérez-Torrente, M. A. Casado, F. J. Lahoz, L. A. Oro Keywords: structure of coordination complexes, early-late metallomacrocycles, heterometallic compounds Poster Session: 29 Board:
133 Page in the Book of Abstracts: C303 Download Abstract Structural Aspects of Pyridyl-pyrazole Dinuclear Rh and Ir Complexes Authors: M. J. Fabra-Caro, A. P. Martínez, M. P. García, F. J. Lahoz, L. A. Oro Keywords: structure of organometallic complexes, metal-metal interactions, intermolecular packing Poster Session: 29 Board:
134 Page in the Book of Abstracts: C304 Download Abstract Spin State and Stereochemistry in Tetracoordinate Complexes of dn Transition Metals Authors: J. Cirera, E. Ruiz, S. Alvarez Keywords: continuous shape measures, spin state, transition metal complex Poster Session: 29 Board:
135 Page in the Book of Abstracts: C304 Download Abstract Structure Determination of Twinned and Disordered Cyclopentadienyl Complexes Authors: U. Baisch, O. Oeckler, S. Pagano, W. Schnick Keywords: organometallic crystal structures, lanthanides, crystal disorder Poster Session: 29 Board:
136 Page in the Book of Abstracts: C304 Download Abstract 07 Crystallography of Organometallic, Co-ordination and Main Group Compounds 11. No sub theme X-ray Structural Study of σ-borane and Dhydridoborate Ruthenium Complexes Authors: L. Vendier, S. Lachaize, S. Sabo-Etienne Keywords: low temperature, hydride structures, Fourier maps Poster Session: 29 Board:
137 Page in the Book of Abstracts: C313 Download Abstract 08 Structure/Property Relationship 3. Dynamic Properties In Molecular Crystals Dynamics of Nucleoside and Nucleotide Hydrates by MD Simulation Authors: S. Yoneda, Y. Sugawara, H. Urabe Keywords: MD simulation, hydrates, nucleic acid Poster Session: 29 Board:
138 Page in the Book of Abstracts: C316 Download Abstract A Novel Spin Transition Curve in [tris(2-picolylamine)Fe(II)]Cl2 Allyl Solvate Authors: B. Vangdal, M. Hostettler, D. Chernyshov, K. W. Törnroos, H.-B. Bürgi Keywords: spin crossover, phase transition, order-disorder Poster Session: 29 Board:
139 Page in the Book of Abstracts: C317 Download Abstract 08 Structure/Property Relationship 4. Solid State Reactions Solid State Synthesis and Characterization of Some Novel Sodium Rare Earth Phosphates Authors: S. Seyyidoglu, M. Ozenbas, M. Kizilyalli, A. Yilmaz Keywords: rare-earths, oxyphosphates, solid-state Poster Session: 29 Board:
140 Page in the Book of Abstracts: C317 Download Abstract The Systems Li-Ho-P-O and K-Ho-P-O: A Study in Inert Atmosphere Authors: I. Rosales, E. A. Juarez-Arellano, L. Bucio, E. Orozco, C. R. Magaña Keywords: phosphates, phase identification, X-ray diffraction Poster Session: 29 Board:
141 Page in the Book of Abstracts: C317 Download Abstract Studies of Spin Crossover Complexes via Solvo-thermal Syntheses and their Thermal Relaxation of Light Excited Kinetic Phenomena Authors: S.-M. Chen, K. W. Chen, C. F. Sheu, G. H. Lee, Y. Wang Keywords: LIESST, spin crossover, thermal relaxation Poster Session: 29 Board:
142 Page in the Book of Abstracts: C317 Download Abstract Study of the Mechanism of Cu-Zn Mechanical Alloying by X-ray Powder Diffraction Authors: M. J. Diánez, J. M. Criado, J. M. Blanes, E. Donoso, A. Varschavsky Keywords: Cu-Zn alloy, mechanical alloying, Cu-Zn phase diagram Poster Session: 29 Board:
143 Page in the Book of Abstracts: C317 Download Abstract Studies on the Solid State Structures and Properties of Metal Arenedisulfonates Authors: J. Cai Keywords: sulfonate, coordination chemistry, solid state structure and property Poster Session: 29 Board:
144 Page in the Book of Abstracts: C318 Download Abstract Structure Analysis of the Excited Molecules in the Equilibrium State Authors: Y. Ohashi, M. Hoshino, A. Sekine, H. Uekusa Keywords: excited molecule, photoreaction, equlibrium state Poster Session: 29 Board:
145 Page in the Book of Abstracts: C318 Download Abstract X-ray Induced Changes in Organic and Biological Crystalline Materials Authors: F. Camus, C. Besnard, M. Fleurant, I. Margiolaki, P. Pattison, M. Schiltz Keywords: synchrotron powder diffraction, radiation chemistry, radiation damage studies Poster Session: 29 Board:
146 Page in the Book of Abstracts: C318 Download Abstract 08 Structure/Property Relationship 6. Phase Transitions Metal-Insulator Transition in Hollandite Vanadate, K2V8O16 Authors: Y. Ueda, N. Kouno, M. Isobe, T. Yamauchi, H. Ueda Keywords: metal oxide, metal insulator transition, structure transformation Poster Session: 29 Board:
147 Page in the Book of Abstracts: C321 Download Abstract 09 Crystal Engineering 5. Intermolecular Interactions: Exploitation Highly Symmetrical Hydrogen-bonded Networks Authors: M. G. Haywood, B. F. Abrahams, T. A. Hudson, R. Robson Keywords: crystal engineering, guanidinium cation, hydrogen-bonded networks Poster Session: 29 Board:
148 Page in the Book of Abstracts: C360 Download Abstract Supramolecular Approach to Generation and Stabilization of Labile Organic Anions Authors: T. C. W. Mak, C.-K. Lam Keywords: hydrogen bonding in organic crystals, supramolecular assemblies, urea inclusion compounds Poster Session: 29 Board:
149 Page in the Book of Abstracts: C360 Download Abstract Synthesis of 2D and 3D Nets Using Biimidazole Complexes Authors: A. M. E. Griffin, A. G. Orpen Keywords: crystal synthesis, hydrogen bonding, biimidazole complexes Poster Session: 29 Board:
150 Page in the Book of Abstracts: C361 Download Abstract Bio-mimicking Self Assembly in Materials: Role of Hydrogen and Halogen Bonding Authors: A. Vij, J. M. Mabry, W. W. Grabow, V. Vij Keywords: self assembly, biomimicking, halogen bonds Poster Session: 29 Board:
151 Page in the Book of Abstracts: C361 Download Abstract Benzyldimethylalkylammonium Haloplumbates: Organic/Inorganic Composite Materials Authors: M. Hodorowicz, K. Stadnicka Keywords: haloplumbates, alkylammonium cations, structure Poster Session: 29 Board:
152 Page in the Book of Abstracts: C361 Download Abstract Crystalline Supramolecular Ladders via Co-Crystals Authors: T. N. Sokolov, T. Friscic, L. R. Mac Gillivray Keywords: supramolecular chemistry, co-crystals, infinite arrays Poster Session: 29 Board:
153 Page in the Book of Abstracts: C361 Download Abstract M–X…X'–C Halogen Bonds as Efficient and Reliable Supramolecular Synthons in Organic-Inorganic Crystals Authors: F. Zordan, L. Brammer, P. Sherwood Keywords: crystal engineering, halogen bonds, interaction energy Poster Session: 29 Board:
154 Page in the Book of Abstracts: C362 Download Abstract Halogen Bonds in Inorganic Crystal Design Authors: G. Minguez, L. Brammer Keywords: crystal engineering, halogen bonds, database study Poster Session: 29 Board:
155 Page in the Book of Abstracts: C362 Download Abstract Control of Reactivity in the Solid State through Principles of Supramolecular Chemistry Authors: T. Friscic, L. R. Mac Gillivray Keywords: solid state reactivity, supramolecular assemblies, photochemistry Poster Session: 29 Board:
156 Page in the Book of Abstracts: C362 Download Abstract Halogen Bonding in Crystal Engineering Authors: P. Metrangolo, T. Pilati, G. Resnati, M. Ursini Keywords: supramolecular chemistry , halogens, intermolecular interactions Poster Session: 29 Board:
157 Page in the Book of Abstracts: C362 Download Abstract A Non-Symmetric Disordered Tetramer: The Unusual Structure of 3(5)-Ethyl-5(3)-phenyl-1H-pyrazole in the Solid State Authors: R. M. Claramunt, P. Cornago, M. D. Santa Maria, V. Torres, E. Pinilla, M. R. Torres, J. Elguero Keywords: hydrogen bonding, pyrazoles, supramolecular architectures Poster Session: 29 Board:
158 Page in the Book of Abstracts: C362 Download Abstract Topologic Features of Three Structures Based on I...Base Halogen Bonding Authors: T. Pilati, P. Metrangolo, D. M. Proserpio, G. Resnati Keywords: topology, crystal engineering, halogen bonding Poster Session: 29 Board:
159 Page in the Book of Abstracts: C363 Download Abstract Inter- and Intra-solid Reactions Studied by X-ray Powder Diffraction Authors: A. Neels, D. Gonzalez Mantero, H. Stoeckli-Evans Keywords: green chemistry, crystal engineering, X-ray powder diffraction Poster Session: 29 Board:
160 Page in the Book of Abstracts: C363 Download Abstract Anion-Dependent Switch between Sheets and Diamondoid Assembly for Zn(LOH)2X2 Authors: E. Bosetti, A. Bacchi, M. Carcelli Keywords: crystal engineering, nonbonded interactions, diamondoid Poster Session: 29 Board:
161 Page in the Book of Abstracts: C363 Download Abstract 2-D and 3-D Metal-Organic Frameworks: A Crystal Engineering Approach Authors: D. Gonzalez Mantero, A. Neels, F. Stoeckli, H. Stoeckli-Evans Keywords: crystal engineering, nano-porous materials, physical adsorption Poster Session: 29 Board:
162 Page in the Book of Abstracts: C363 Download Abstract The Interplay between N-H…O Hydrogen Bonding and Cl…Cl Interactions in Arylformamides Authors: D. C. Levendis, M. A. Fernandes, M. S. Layh, T. S. Mkwizu, B. Omondi Keywords: polymorph, phase-transitions, hydrogen bonding Poster Session: 29 Board:
163 Page in the Book of Abstracts: C364 Download Abstract 12 Surfaces, Interfaces, Liquids and Thin Films 2. Surfaces and Catalysis Chemical preparation of GaAs (100), (110), (111) and (112) substrates with HF:H2O2: Citric acid:H2O Authors: T. F. Diaz Becerril, A. Alvarado, E. Rosendo, H. Juárez, G. García, J. Martínez, M. Rubín Keywords: surface quality , chemical preparation, rate of etching Poster Session: 29 Board:
164 Page in the Book of Abstracts: C410 Download Abstract 12 Surfaces, Interfaces, Liquids and Thin Films 6. Recent Liquid Structure Determination Hydrogen-Bonded Structure of Alcohols Adsorbed on Silica Surface in Cyclohexane Authors: K. Kurihara, M. Mizukami, S. Endo Keywords: solid liquid interaction, interfacial liquid structure, hydrogen bonding Poster Session: 29 Board:
165 Page in the Book of Abstracts: C411 Download Abstract 12 Surfaces, Interfaces, Liquids and Thin Films 12. Magnetic and Conducting Properties of Thin Films The Influence of Thermal Annealing on Magnetostatic Properties of Thin Fe and Ni Films Authors: E. Tamanis, E. E. Shaligina, L. Kozlovsky Keywords: thin film, magnetic properties, annealing Poster Session: 29 Board:
166 Page in the Book of Abstracts: C416 Download Abstract 14 Charge, Spin and Momentum Density 1. Multipole and Other Modelling Methods Comparative Charge Density Studies on Tripeptides of the Ala-Xxx-Ala-type Authors: D. Foerster, E. Roedel, P. Luger Keywords: charge density, peptide crystallography, high resolution crystal structures Poster Session: 29 Board:
167 Page in the Book of Abstracts: C419 Download Abstract Charge Density of Amino Acids with Strong Hydrogen Bonds: A Comparative Study Authors: S. Mebs, C. Hueschle, P. Luger Keywords: charge density, amino acid complexes, hydrogen bond Poster Session: 29 Board:
168 Page in the Book of Abstracts: C419 Download Abstract Experimental Charge Density Study on Vitamin B12 Authors: T. Koritsanszky, B. Dittrich, S. Nebs, P. Luger Keywords: charge density, vitamin B12, bioactive compounds Poster Session: 29 Board:
169 Page in the Book of Abstracts: C419 Download Abstract Determination of ‘Experimental’ Wavefunctions from X-ray Diffraction Data Authors: M. J. Turner, J. Howard, D. Yufit, D. Jayatilaka Keywords: charge density, electrostatic properties, semiempirical calculations Poster Session: 29 Board:
170 Page in the Book of Abstracts: C419 Download Abstract Comparing Charge Densities of Opioids: Morphine, Codeine and Dextrometorphane Authors: S. Scheins, M. Messerschmid, P. Luger Keywords: charge density, CCD detectors, low temperature Poster Session: 29 Board:
171 Page in the Book of Abstracts: C419 Download Abstract Thymidin Invariom Transfer and Multipole Refinement of a 20 K Data Set: A Comparison Authors: C. B. Huebschle, B. Dittrich, M. Messerschmidt, P. Luger Keywords: charge density, nucleosides, high resolution Poster Session: 29 Board:
172 Page in the Book of Abstracts: C420 Download Abstract Experimental Electron Density and Topological Analysis of D- and DL- Camphoric Anhydride Authors: K. Poomani, T. Koritsanszkyb Keywords: charge density, non centrosymmetry, multipole model Poster Session: 29 Board:
173 Page in the Book of Abstracts: C420 Download Abstract Light on Phase IV in Ce0.7La0.3B6 Authors: D. Mannix, Y. Tanaka, D. Carbone, N. Bernhoeft, K. Katsumata, S. Kunii Keywords: resonant scattering, multipole order, spin and charge density Poster Session: 29 Board:
174 Page in the Book of Abstracts: C420 Download Abstract Anisotropic Displacement Parameters (ADPs) of Hydrogen Atoms. Can Invariom Modeling Contribute? Authors: B. Dittrich, A. E. Whitten, M. A. Spackman Keywords: charge density, thermal parameters, ab initio calculations Poster Session: 29 Board:
175 Page in the Book of Abstracts: C420 Download Abstract 14 Charge, Spin and Momentum Density 2. Software Developments Advances in Charge Density and Electrostatic Interaction Analyses Authors: C. Jelsch, A. Lagoutte, B. Guillot, V. Pichon-Pesme, C. Lecomte Keywords: charge density, protein, databases Poster Session: 29 Board:
176 Page in the Book of Abstracts: C421 Download Abstract 14 Charge, Spin and Momentum Density 3. Applications of Synchrotron Data Bond-dependent Crystal Response on Electric Field: Synchrotron Diffraction Study Authors: U. Pietsch, S. Gorfman, V. Tsireslon Keywords: X-ray diffraction, dielectric properties, chemical bonding Poster Session: 29 Board:
177 Page in the Book of Abstracts: C421 Download Abstract Electron Density Analysis of Borocarbides Authors: T. Leisegang, D. C. Meyer, D. Souptel, G. Behr, J. Wosnitza, P. Paufler Keywords: rare earth compounds, superconductors, electron density Poster Session: 29 Board:
178 Page in the Book of Abstracts: C421 Download Abstract Chemical Bonding and Electronic Configuration of Nitrosyl Iron Complexes Authors: I.-J. Hsu, T.-Y. Wang, J.-J. Lee, C.-H. Hsieh, G.-H. Lee, W.-F. Liaw, Y. Wang Keywords: nitrosyl, BCP, X-ray absorption spectroscopy Poster Session: 29 Board:
179 Page in the Book of Abstracts: C421 Download Abstract Pump and Probe the Structure and Electronic Configuration of LIESST State Authors: Y. Wang, C. F. Sheu, I-J. Hsu, Y-C. Lin, B. N. Wang, K. Toriumi, Y. Ozawa Keywords: spin crossover, X-ray absorption spectroscopy, excited spin state Poster Session: 29 Board:
180 Page in the Book of Abstracts: C421 Download Abstract 14 Charge, Spin and Momentum Density 4. Maximum Entropy Applications Structure Refinements of Protein-ligand Complex by the Maximum Entropy Method Authors: M. Sakata, T. Kajikawa, E. Nishibori, H. Ago, K. Hamada, J. Ishijima, M. Miyano Keywords: protein structure refinement, maximum entropy method, Rpi Poster Session: 29 Board:
181 Page in the Book of Abstracts: C422 Download Abstract Maximum-entropy and Fourier Study on Electron Density of MnO, LaCoO3 and MgSiO3 Authors: M. Tada, S. Ishikawa, M. Sakata, K. Ohkubo, T. Kyomen, E. Nishibori, S. Sasaki Keywords: maximum entropy method, fourier methods, electron density distribution Poster Session: 29 Board:
182 Page in the Book of Abstracts: C422 Download Abstract 14 Charge, Spin and Momentum Density 5. Experimental Methods and Techniques Electron Density in Cubic SrTiO3 from γ-ray Diffraction Authors: W. Jauch, M. Reehuis Keywords: γ-ray diffraction, charge density, perovskite oxide Poster Session: 29 Board:
183 Page in the Book of Abstracts: C422 Download Abstract High-resolution Magnetic Compton Profile of Iron Authors: M. Itou, Y. Sakurai, A. Koizumi, N. Sakai Keywords: magnetic Compton scattering, momentum density, X-ray spectrometer Poster Session: 29 Board:
184 Page in the Book of Abstracts: C422 Download Abstract The Effect of Fourier Series Truncation Errors on the Electron Density Distribution of LiMn2O4 Authors: N. Ishizawa, K. Tateishi, D. du Boulay Keywords: electron density distribution, Fourier methods, molecular dynamics Poster Session: 29 Board:
185 Page in the Book of Abstracts: C423 Download Abstract Ultra-high Resolution Data for Charge Densities Studies Authors: M. Chruszcz, M. Cymborowski, A. Makal, Z. Otwinowski, K. Wozniak, W. Minor Keywords: charge density, data collection, Kα1-Kα2 split Poster Session: 29 Board:
186 Page in the Book of Abstracts: C423 Download Abstract Electron Density and Electrostatic Potential Study of an Organic Phosphate Authors: E. Molins, I. Mata, E. Espinosa Keywords: electron density, electrostatic potential, organic phosphates Poster Session: 29 Board:
187 Page in the Book of Abstracts: C423 Download Abstract Accurate Charge Densities in under a Day with a Home X-ray Source Authors: A. A. Pinkerton, V. V. Zhurov, E. A. Zhurova, Y.-S. Chen Keywords: charge density, home X-ray source, rapid collection Poster Session: 29 Board:
188 Page in the Book of Abstracts: C423 Download Abstract 14 Charge, Spin and Momentum Density 6. Topological Analyses Topological Analysis of Charge Densities in Polymorphs of 3-Acetylcoumarin Authors: P. Munshi, T. N. Guru Row Keywords: charge density distribution, polymorphs, lattice energy calculations Poster Session: 29 Board:
189 Page in the Book of Abstracts: C423 Download Abstract Experimental and Theoretical Charge Densities of Fe(CO)3(η4-C4H6) Authors: C. Evans, L. J. Farrugia Keywords: experimental charge density, DFT, carbonyl Poster Session: 29 Board:
190 Page in the Book of Abstracts: C424 Download Abstract Multipole-Refined Charge Density Study of Diopside Authors: R. Bianchi, A. Forni, R. Oberti Keywords: charge density distribution, topological properties of charge distribution, silicates Poster Session: 29 Board:
191 Page in the Book of Abstracts: C424 Download Abstract Topological Analysis of Bio-molecules Authors: C.-R. Lee, C.-Y. Lee, A. H.-J. Wang Keywords: charge density, multipole model, topological properties of charge density Poster Session: 29 Board:
192 Page in the Book of Abstracts: C424 Download Abstract Charge Density and Topological Properties of Chosen Aromatic Nitramines Authors: J. Zaleski, B. Zarychta, Z. Daszkiewicz, C. Jelsch, C. Lecomte Keywords: charge density, nitramines, topology Poster Session: 29 Board:
193 Page in the Book of Abstracts: C424 Download Abstract Rapid Charge Density Data Collection Authors: D. Parrish, J. R. Deschamps, A. Coop, L. N. Thatcher, H. Wu, J. Ferrara, L. Daniels Keywords: electron density distribution, charge density, chemical reactivity and structure Poster Session: 29 Board:
194 Page in the Book of Abstracts: C425 Download Abstract 14 Charge, Spin and Momentum Density 8. Magnetisation and Spin Densities On the Conditions Leading to the Gaussian Distribution of the Magnetic Moments in a Spin-glass State Authors: P. Gusin, J. Warczewski Keywords: spin glass, probability, central theorem of the theory of probability Poster Session: 29 Board:
195 Page in the Book of Abstracts: C429 Download Abstract Spin Density and Ordered Orbital of YTiO3 Observed by X-ray Magnetic Diffraction Authors: N. Tsuji, M. Ito, H. Akiyama, K. Suzuki, H. Adachi, H. Nakao, Y. Murakami, Y. Tokura Keywords: magnetic X-ray scattering , spin density, titanium oxide compounds Poster Session: 29 Board:
196 Page in the Book of Abstracts: C429 Download Abstract 14 Charge, Spin and Momentum Density 10. No sub theme Charge Density Study of Cu3(en)2(CN)4•H2O Authors: M. Fronc, J. Kožíšek, H. Fuess, C. Paulmann Keywords: charge density, copper (I), copper (II) Poster Session: 29 Board:
197 Page in the Book of Abstracts: C430 Download Abstract 15 Diffraction Physics and Optics 8. Dynamical Diffraction Dynamics from Diffraction Authors: A. Goodwin, M. Tucker, M. Dove, D. Keen Keywords: dynamic properties, diffraction theory, reverse Monte Carlo Poster Session: 29 Board:
198 Page in the Book of Abstracts: C434 Download Abstract 17 Characterization of Defects, Microstructures and Textures 2. Electron Microscopy Mixed Metal Oxide Nanoparticles – Synthesis and Characterisation Authors: P. Franklyn, D. Jefferson Keywords: mixed oxides, nanoparticles, TEM Poster Session: 29 Board:
199 Page in the Book of Abstracts: C447 Download Abstract Fivefold Twinning of Diamond Authors: S. I. Son, S. J. Chung Keywords: five fold twin, twin boundary, diamond Poster Session: 29 Board:
200 Page in the Book of Abstracts: C447 Download Abstract 17 Characterization of Defects, Microstructures and Textures 5. STM and AFM Microscopy Local Elastic Measurement in Nanostructured Materials via Atomic Force Acoustic Microscopy Technique Authors: D. Passeri, A. Alippi, A. Bettucci, M. Germano, M. Rossi, M. L. Terranova, E. Tamburri, S. Orlanducci Keywords: AFM, elastic properties, nanoanalysis Poster Session: 29 Board:
201 Page in the Book of Abstracts: C452 Download Abstract 17 Characterization of Defects, Microstructures and Textures 6. Other Techniques Including Polarised Light and Infrared Studies Spatial Maps of Eu-aggregates in NaCl:Eu2+ and KCl:KBr:Eu2+ Single-crystals Authors: A. E. Cordero-Borboa Keywords: mixed alkali halides, optical epifluorescence, europium impurities Poster Session: 29 Board:
202 Page in the Book of Abstracts: C453 Download Abstract 19 Electron Diffraction 1. New Techniques and New Instrumentation Generation and Characterization of Ultrashort Electron Pulses Authors: C. Hebeisen, J. R. Dwyer, R. E. Jordan, M. Harb, R. Ernstorfer, R. J. D. Miller Keywords: ultrafast electron diffraction, electron pulse propagation dynamics, electron pulse characterization Poster Session: 29 Board:
203 Page in the Book of Abstracts: C457 Download Abstract Ultrafast Melting in Metals Probed with Femtosecond Electron Diffraction Authors: J. Dwyer, R. E. Jordan, C. T. Hebeisen, M. Harb, R. Ernstorfer, R. J. Dwayne Miller Keywords: ultrafast electron diffraction, ultrafast melting, time resolved Poster Session: 29 Board:
204 Page in the Book of Abstracts: C457 Download Abstract 19 Electron Diffraction 2. High Resolution Results 3-D Structure Determination of CaMoO4 Using HVEM Authors: J.-G. Kim, Y.-J. J. Kim, J.-P. Kim Keywords: electron crystallography, inorganic materials, HRTEM Poster Session: 29 Board:
223 Page in the Book of Abstracts: C457 Download Abstract 24 Databases 1. Creation and Exploitation COD (Crystallography Open Database) and PCOD (Predicted) Authors: A. Le Bail, D. Chateigner, X. Chen, M. Ciriotti, L. M. D. Cranswick, R. T. Downs, L. Lutterotti, A. F. T. Yokochi Keywords: crystal structure database, open access, COD Poster Session: 29 Board:
205 Page in the Book of Abstracts: C481 Download Abstract Hydrogen and Hydration DataBase for Bio-Macromolecules (HHDB) Authors: R. Kuroki, T. Chatake, K. Kurihara, T. Ohhara, H. Umino, R. E. Cachau, M. Blaber, N. Niimura Keywords: neutron diffraction, protein, hydrogen bond Poster Session: 29 Board:
206 Page in the Book of Abstracts: C481 Download Abstract Four Years of the EPSRC SRS Service Authors: R. Harrington, W. Clegg Keywords: EPSRC, national crystallographic service , statistics Poster Session: 29 Board:
207 Page in the Book of Abstracts: C481 Download Abstract 24 Databases 2. Coping with Rapid Expansions of Data. The Next Generation of databases The Crystallographic Semantic Web Authors: P. Murray-Rust, S. Tyrrell, Y. Zhang Keywords: XML, CIF, sematic Web Poster Session: 29 Board:
208 Page in the Book of Abstracts: C481 Download Abstract ECRYSTALS(.CHEM.SOTON.AC.UK): Open Archive Publication of Crystal Structure Data Authors: M. Hursthouse, S. J. Coles, J. G. Frey, L. Carr, C. Gutteridge, L. Lyon, R. Heery, M. Duke, M. Day Keywords: structural databases, e-Science, data harvesting Poster Session: 29 Board:
209 Page in the Book of Abstracts: C481 Download Abstract 24 Databases 3. Research Applications of the CSD Hydrogen Bond Capacity of Organic Functional Groups: a CSD derived Database Authors: S. Motherwell, L. Infantes Keywords: hydrogen bond, databases, functional groups Poster Session: 29 Board:
210 Page in the Book of Abstracts: C482 Download Abstract 24 Databases 4. Research Applications of the PDB/NADB Unveiling the omega/psi Correlation in High Resolution Protein Structures Authors: L. Esposito, A. De Simone, A. Zagari, L. Vitagliano Keywords: peptide planarity, statistical analysis, conformation Poster Session: 29 Board:
211 Page in the Book of Abstracts: C482 Download Abstract Beyond Text-based Queries at the Protein Data Bank, Japan Authors: D. M. Standley, H. Nakamura Keywords: protein structure comparison, databases, protein protein interactions Poster Session: 29 Board:
212 Page in the Book of Abstracts: C482 Download Abstract 24 Databases 6. Research Applications of the PDF Implementation of Calculated Patterns Quality Marks in The Powder Diffraction File Authors: S. Kabekkodu Keywords: phase identification, powder diffraction, data checking Poster Session: 29 Board:
213 Page in the Book of Abstracts: C482 Download Abstract The New PDF-4+ 2005: A Relational Database (RDB) with Atomic Structure Information and On-the-fly Total Pattern Analysis Capability Authors: J. Faber, S. Kabekkodu Keywords: database preparation, powder diffraction, powder patterns Poster Session: 29 Board:
214 Page in the Book of Abstracts: C483 Download Abstract 24 Databases 7. Data Mining and Knowledge Generation Carbonyl-Carbonyl Interactions in First-row Transition Metal Complexes Authors: H. A. Sparkes, M. F. Mahon, P. R. Raithby, F. H. Allen, G. P. Shields Keywords: database manipulation, transition metal complex, interatomic interactions Poster Session: 29 Board:
215 Page in the Book of Abstracts: C483 Download Abstract ISOBASEmm: Isostructurality in the Protein Data Bank Authors: J. M. M. Smits, R. de Gelder Keywords: protein structure comparison, isostructurality, databases Poster Session: 29 Board:
216 Page in the Book of Abstracts: C483 Download Abstract Powder Diffraction CIFs: Preparation and Review. Authors: B. Toby, N. Ashcroft Keywords: CIF, powder diffraction, Rietveld analysis Poster Session: 29 Board:
217 Page in the Book of Abstracts: C483 Download Abstract Automating the Identification of Packing Motifs; dSNAP Authors: G. Barr, A. Parkin, W. Dong, C. J. Gilmore, C. C. Wilson Keywords: database mining, cluster analysis, intermolecular packing Poster Session: 29 Board:
218 Page in the Book of Abstracts: C483 Download Abstract Description of Software for the Planning, Execution, and Refinement of Crystallography Experiments Authors: P. Vinson, B. Greenway, G. Nordstrom, D. Riling Keywords: software for crystallography, application software,databases Poster Session: 29 Board:
219 Page in the Book of Abstracts: C484 Download Abstract 24 Databases 8. Bio-informatics: The Future Covariance Correlations from Genome-Wide Homology Sequence Analysis of DHFR Authors: V. Cody, W. Duax, R. Huether Keywords: genome, dihydrofolate reductase, profiles Poster Session: 29 Board:
220 Page in the Book of Abstracts: C484 Download Abstract The PDB Format in the 21st Century, a Modest Proposal Authors: H. J. Bernstein, F. C. Bernstein Keywords: PDB, mmCIF, software Poster Session: 29 Board:
221 Page in the Book of Abstracts: C484 Download Abstract 24 Databases 10. No sub theme Protein Crystallization Conditions Database, Crystal T.B. Authors: K. Inaka, S. Sugiyama, F. Shibata, Y. Kobayashi, J. Ohori, K. Sugimori, J. M. Ciloy, M. Kitajima, T. Sakamaki, Y. Sato, S. Masumoto Keywords: databases, crystallization, screening Poster Session: 29 Board:
222 Page in the Book of Abstracts: C484 Download Abstract Late Abstracts 1 EM and X-ray Studies of HupR, A Response Regulator from the NtrC Family Authors: K. Davies, L. Johnson, C. Vénien-Bryan Keywords: electron crystallography, response regulators, NtrC Poster Session: 29 Board:
223 Page in the Book of Abstracts: C0 Download Abstract
This is an archive of the official website for the IUCrXX Congress at Florence in 2005. Some images and text may be missing and some links no longer work.
