PDB: 225399 件ウェブページステータス検索Chemie searchBIRD

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4EFZ	Crystal Structure of a hypothetical metallo-beta-lactamase from Burkholderia pseudomallei 分子名称: 1,2-ETHANEDIOL, CALCIUM ION, CHLORIDE ION, ... 著者 SSGCID, Seattle Structural Genomics Center for Infectious Disease, Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2012-03-30 公開日 2012-05-09 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 Crystal Structure of a hypothetical metallo-beta-lactamase from Burkholderia pseudomallei TO BE PUBLISHED
4EKS	T4 Lysozyme L99A/M102H with Isoxazole Bound 分子名称: 1,2-benzisoxazole, 2-HYDROXYETHYL DISULFIDE, ACETATE ION, ... 著者 Merski, M, Shoichet, B.K. 登録日 2012-04-09 公開日 2012-09-05 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.64 Å) 主引用文献 Engineering a model protein cavity to catalyze the Kemp elimination. Proc.Natl.Acad.Sci.USA, 109, 2012
4EL7	Initial Thaumatin Structure for Radiation Damage Experiment at 300 K 分子名称: L(+)-TARTARIC ACID, Thaumatin-1 著者 Warkentin, M, Badeau, R, Hopkins, J.B, Thorne, R.E. 登録日 2012-04-10 公開日 2012-08-29 最終更新日 2013-01-23 実験手法 X-RAY DIFFRACTION (1.52 Å) 主引用文献 Spatial distribution of radiation damage to crystalline proteins at 25-300 K. Acta Crystallogr.,Sect.D, 68, 2012
4ENT	Structure of the S234A variant of E. coli KatE 分子名称: CIS-HEME D HYDROXYCHLORIN GAMMA-SPIROLACTONE, Catalase HPII, PROTOPORPHYRIN IX CONTAINING FE 著者 Loewen, P.C, Jha, V. 登録日 2012-04-13 公開日 2012-05-02 最終更新日 2013-02-27 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Influence of main channel structure on H(2)O(2) access to the heme cavity of catalase KatE of Escherichia coli. Arch.Biochem.Biophys., 526, 2012
4EQJ	Crystal Structure of inactive single chain variant of HIV-1 Protease in Complex with the substrate RT-RH 分子名称: 1,2-ETHANEDIOL, GLYCEROL, protease, ... 著者 Schiffer, C.A, Mittal, S. 登録日 2012-04-19 公開日 2012-06-06 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Structural, kinetic, and thermodynamic studies of specificity designed HIV-1 protease. Protein Sci., 21, 2012
4D8C	Crystal Structure of Human Beta Secretase in Complex with NVP-BXD552, derived from a co-crystallization experiment 分子名称: (3S,4S,5R)-3-(4-amino-3-{[(2R)-3-ethoxy-1,1,1-trifluoropropan-2-yl]oxy}-5-fluorobenzyl)-5-[(3-tert-butylbenzyl)amino]tetrahydro-2H-thiopyran-4-ol 1,1-dioxide, Beta-secretase 1, SULFATE ION 著者 Rondeau, J.M, Bourgier, E. 登録日 2012-01-10 公開日 2012-11-21 実験手法 X-RAY DIFFRACTION (2.07 Å) 主引用文献 Discovery of cyclic sulfone hydroxyethylamines as potent and selective beta-site APP-cleaving enzyme 1 (BACE1) inhibitors: structure based design and in vivo reduction of amyloid beta-peptides J.Med.Chem., 55, 2012
4D8Y	Crystal structure of the hexameric purine nucleoside phosphorylase from Bacillus subtilis in space group P212121 at pH 5.6 分子名称: GLYCEROL, Purine nucleoside phosphorylase deoD-type, SULFATE ION 著者 Santos, C.R, Meza, A.N, Martins, N.H, Giuseppe, P.O, Murakami, M.T. 登録日 2012-01-11 公開日 2012-09-26 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.61 Å) 主引用文献 Insights into phosphate cooperativity and influence of substrate modifications on binding and catalysis of hexameric purine nucleoside phosphorylases. Plos One, 7, 2012
4D89	Crystal Structure of Human Beta Secretase in Complex with NVP-BXD552, derived from a soaking experiment 分子名称: (3S,4S,5R)-3-(4-amino-3-{[(2R)-3-ethoxy-1,1,1-trifluoropropan-2-yl]oxy}-5-fluorobenzyl)-5-[(3-tert-butylbenzyl)amino]tetrahydro-2H-thiopyran-4-ol 1,1-dioxide, Beta-secretase 1 著者 Rondeau, J.M, Bourgier, E. 登録日 2012-01-10 公開日 2012-11-21 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Discovery of cyclic sulfone hydroxyethylamines as potent and selective beta-site APP-cleaving enzyme 1 (BACE1) inhibitors: structure based design and in vivo reduction of amyloid beta-peptides J.Med.Chem., 55, 2012
4D8Z	Crystal structure of B. anthracis DHPS with compound 24 分子名称: (3R)-3-(7-amino-4,5-dioxo-1,4,5,6-tetrahydropyrimido[4,5-c]pyridazin-3-yl)butanoic acid, Dihydropteroate Synthase, SULFATE ION 著者 Hammoudeh, D, Lee, R.E, White, S.W. 登録日 2012-01-11 公開日 2012-03-28 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.198 Å) 主引用文献 Structure-Based Design of Novel Pyrimido[4,5-c]pyridazine Derivatives as Dihydropteroate Synthase Inhibitors with Increased Affinity. Chemmedchem, 7, 2012
4D9Q	Inhibiting Alternative Pathway Complement Activation by Targeting the Exosite on Factor D 分子名称: Anti-Factor D, heavy chain, light chain, ... 著者 Murray, J.M, Wiesmann, C. 登録日 2012-01-11 公開日 2012-02-22 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.28 Å) 主引用文献 Inhibiting alternative pathway complement activation by targeting the factor d exosite. J.Biol.Chem., 287, 2012
4D8H	Crystal structure of Symfoil-4P/PV2: de novo designed beta-trefoil architecture with symmetric primary structure, primitive version 2 (6xLeu / PV1) 分子名称: 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, SULFATE ION, de novo protein 著者 Blaber, M, Longo, L. 登録日 2012-01-10 公開日 2013-01-16 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.901 Å) 主引用文献 Simplified protein design biased for prebiotic amino acids yields a foldable, halophilic protein. Proc.Natl.Acad.Sci.USA, 110, 2013
4D9R	Inhibiting Alternative Pathway Complement Activation by Targeting the Exosite on Factor D 分子名称: CHLORIDE ION, Complement factor D, Fab heavy chain, ... 著者 Murray, J.M, Wiesmann, C. 登録日 2012-01-11 公開日 2012-02-22 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.42 Å) 主引用文献 Inhibiting alternative pathway complement activation by targeting the factor d exosite. J.Biol.Chem., 287, 2012
4D9T	Rsk2 C-terminal Kinase Domain with inhibitor (E)-methyl 3-(4-amino-7-(3-hydroxypropyl)-5-p-tolyl-7H-pyrrolo[2,3-d]pyrimidin-6-yl)-2-cyanoacrylate 分子名称: Ribosomal protein S6 kinase alpha-3, SODIUM ION, methyl (2S)-3-{4-amino-7-[(1E)-3-hydroxyprop-1-en-1-yl]-5-(4-methylphenyl)-7H-pyrrolo[2,3-d]pyrimidin-6-yl}-2-cyanopropanoate 著者 Serafimova, I.M, Pufall, M.A, Krishnan, S, Duda, K, Cohen, M.S, Maglathlin, R.L, McFarland, J.M, Miller, R.M, Frodin, M, Taunton, J. 登録日 2012-01-12 公開日 2012-04-25 最終更新日 2012-05-16 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Reversible targeting of noncatalytic cysteines with chemically tuned electrophiles. Nat.Chem.Biol., 8, 2012
4ETU	Crystal structure of rabbit ryanodine receptor 1 mutant R2939S 分子名称: GLYCEROL, Ryanodine receptor 1 著者 Yuchi, Z, Lau, K, Van Petegem, F. 登録日 2012-04-24 公開日 2012-06-13 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.19 Å) 主引用文献 Disease mutations in the ryanodine receptor central region: crystal structures of a phosphorylation hot spot domain. Structure, 20, 2012
4EU7	Succinyl-CoA:acetate CoA-transferase (AarCH6) in complex with CoA and citrate 分子名称: CHLORIDE ION, CITRIC ACID, COENZYME A, ... 著者 Mullins, E.A, Kappock, T.J. 登録日 2012-04-25 公開日 2012-10-10 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Crystal Structures of Acetobacter aceti Succinyl-Coenzyme A (CoA):Acetate CoA-Transferase Reveal Specificity Determinants and Illustrate the Mechanism Used by Class I CoA-Transferases. Biochemistry, 51, 2012
4EUM	Crystal structure of a sugar kinase (Target EFI-502132) from Oceanicola granulosus with bound AMP, crystal form II 分子名称: 2-dehydro-3-deoxygluconokinase, ADENOSINE MONOPHOSPHATE, CHLORIDE ION, ... 著者 Vetting, M.W, Toro, R, Bhosle, R, Al Obaidi, N.F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Washington, E, Scott Glenn, A, Chowdhury, S, Evans, B, Hammonds, J, Hillerich, B, Love, J, Seidel, R.D, Imker, H.J, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI) 登録日 2012-04-25 公開日 2012-05-16 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Crystal structure of a sugar kinase (Target EFI-502132) from Oceanicola granulosus with bound AMP, crystal form II To be Published
4EEZ	Crystal Structure of Lactococcus lactis Alcohol Dehydrogenase variant RE1 分子名称: Alcohol dehydrogenase 1, TETRAETHYLENE GLYCOL, ZINC ION 著者 Liu, X, Bastian, S, Snow, C.D, Brustad, E.M, Saleski, T, Xu, J.H, Meinhold, P, Arnold, F.H. 登録日 2012-03-28 公開日 2012-09-26 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structure-guided engineering of Lactococcus lactis alcohol dehydrogenase LlAdhA for improved conversion of isobutyraldehyde to isobutanol. J.Biotechnol., 164, 2012
4EY5	Crystal Structure of Recombinant Human Acetylcholinesterase in Complex with (-)-huperzine A 分子名称: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-[alpha-L-fucopyranose-(1-6)]2-acetamido-2-deoxy-beta-D-glucopyranose, ... 著者 Cheung, J, Rudolph, M, Burshteyn, F, Cassidy, M, Gary, E, Love, J, Height, J, Franklin, M. 登録日 2012-05-01 公開日 2012-10-17 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.3012 Å) 主引用文献 Structures of human acetylcholinesterase in complex with pharmacologically important ligands. J.Med.Chem., 55, 2012
4E4W	Structure of the C-terminal domain of the Saccharomyces cerevisiae MUTL alpha (MLH1/PMS1) heterodimer 分子名称: 1,2-ETHANEDIOL, DNA mismatch repair protein MLH1, DNA mismatch repair protein PMS1, ... 著者 Gueneau, E, Legrand, P, Charbonnier, J.B. 登録日 2012-03-13 公開日 2013-02-20 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Structure of the MutLalpha C-terminal domain reveals how Mlh1 contributes to Pms1 endonuclease site. Nat.Struct.Mol.Biol., 20, 2013
4E5L	Crystal structure of avian influenza virus PAn bound to compound 6 分子名称: 2,3-DIHYDROXY-BENZOIC ACID, MANGANESE (II) ION, Polymerase protein PA, ... 著者 DuBois, R.M, Slavish, P.J, Webb, T.R, White, S.W. 登録日 2012-03-14 公開日 2012-08-08 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.469 Å) 主引用文献 Structural and Biochemical Basis for Development of Influenza Virus Inhibitors Targeting the PA Endonuclease. Plos Pathog., 8, 2012
4E78	Crystal structure of a product state assembly of HCV NS5B genotype 2a JFH-1 isolate with beta hairpin loop deletion bound to primer-template RNA with 3'-dG 分子名称: 5'-R(*U*AP*CP*CP*GP*(GDO))-3', PROTEIN (RNA-directed RNA polymerase) 著者 Edwards, T.E, Mosley, R.T. 登録日 2012-03-16 公開日 2012-04-18 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (2.9 Å) 主引用文献 Structure of hepatitis C virus polymerase in complex with primer-template RNA. J.Virol., 86, 2012
4E8U	Crystal structure of Arabidopsis IDN2 XS domain along with a small segment of adjacent coiled-coil region 分子名称: Putative uncharacterized protein T8P19.180, SULFATE ION 著者 Simanshu, D.K, Patel, D.J. 登録日 2012-03-20 公開日 2012-06-06 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.701 Å) 主引用文献 INVOLVED IN DE NOVO 2-containing complex involved in RNA-directed DNA methylation in Arabidopsis. Proc.Natl.Acad.Sci.USA, 109, 2012
4EG0	Crystal Structure of D-alanine--D-alanine ligase from Burkholderia ambifaria 分子名称: 1,2-ETHANEDIOL, D-alanine--D-alanine ligase 著者 Seattle Structural Genomics Center for Infectious Disease (SSGCID) 登録日 2012-03-30 公開日 2012-05-09 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Combining functional and structural genomics to sample the essential Burkholderia structome. Plos One, 8, 2013
4EHW	Crystal structure of LpxK from Aquifex aeolicus at 2.3 angstrom resolution 分子名称: (4S)-2-METHYL-2,4-PENTANEDIOL, GLYCEROL, Tetraacyldisaccharide 4'-kinase 著者 Emptage, R.P, Daughtry, K.D, Pemble IV, C.W, Raetz, C.R.H. 登録日 2012-04-04 公開日 2012-08-29 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Crystal structure of LpxK, the 4'-kinase of lipid A biosynthesis and atypical P-loop kinase functioning at the membrane interface. Proc.Natl.Acad.Sci.USA, 109, 2012
4EIN	Crystal structure of mouse thymidylate synthase in binary complex with a substrate analogue and strong inhibitor, N(4)-hydroxy-2'-deoxycytidine-5'-monophosphate 分子名称: 2'-deoxy-N-hydroxycytidine 5'-(dihydrogen phosphate), GLYCEROL, Thymidylate synthase 著者 Dowiercial, A, Jarmula, A, Rypniewski, W.R, Wilk, P, Kierdaszuk, B, Rode, W. 登録日 2012-04-05 公開日 2013-04-10 最終更新日 2023-09-13 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 Crystal structures of complexes of mouse thymidylate synthase crystallized with N4-OH-dCMP alone or in the presence of N5,10-methylenetetrahydrofolate PTERIDINES, 2013

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