PDB: 226262 件ウェブページステータス検索Chemie searchBIRD

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4WBF	Acinetobacter baumannii SDF NDK 分子名称: Nucleoside diphosphate kinase 著者 Hu, Y, Liu, Y. 登録日 2014-09-03 公開日 2015-06-17 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (2.64 Å) 主引用文献 Structural and Functional Characterization of Acinetobacter baumannii Nucleoside Diphosphate Kinase Prog.Biochem.Biophys., 42, 2015
4WBK	The 1.37 angstrom X-ray structure of the human heart fatty acid-binding protein complexed with stearic acid 分子名称: Fatty acid-binding protein, heart, STEARIC ACID 著者 Sugiyama, S, Matsuoka, S, Mizohata, E, Matsuoka, D, Murakami, S, Inoue, T, Murata, M. 登録日 2014-09-03 公開日 2015-01-28 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (1.37 Å) 主引用文献 Molecular Dynamics Simulations of Heart-type Fatty Acid Binding Protein in Apo and Holo Forms, and Hydration Structure Analyses in the Binding Cavity J.Phys.Chem.B, 119, 2015
4WBQ	Crystal structure of the exonuclease domain of QIP (QDE-2 interacting protein) solved by native-SAD phasing. 分子名称: CALCIUM ION, QDE-2-interacting protein 著者 Boland, A, Weinert, T, Weichenrieder, O, Wang, M. 登録日 2014-09-03 公開日 2014-12-10 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.693 Å) 主引用文献 Fast native-SAD phasing for routine macromolecular structure determination. Nat.Methods, 12, 2015
4WCD	Trypanosoma brucei PTR1 in complex with inhibitor 10 分子名称: 5-(1H-benzotriazol-6-yl)-1,3,4-thiadiazol-2-amine, ACETATE ION, GLYCEROL, ... 著者 Mangani, S, Di Pisa, F, Pozzi, C. 登録日 2014-09-04 公開日 2015-09-30 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.68 Å) 主引用文献 Exploiting the 2-Amino-1,3,4-thiadiazole Scaffold To Inhibit Trypanosoma brucei Pteridine Reductase in Support of Early-Stage Drug Discovery. ACS Omega, 2, 2017
6Q7I	GH3 exo-beta-xylosidase (XlnD) 分子名称: 1,2-ETHANEDIOL, 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, ... 著者 Davies, G.J, Rowland, R.J, Wu, L, Moroz, O, Blagova, E. 登録日 2018-12-13 公開日 2019-06-05 最終更新日 2024-10-16 実験手法 X-RAY DIFFRACTION (1.48 Å) 主引用文献 Dynamic and Functional Profiling of Xylan-Degrading Enzymes inAspergillusSecretomes Using Activity-Based Probes. Acs Cent.Sci., 5, 2019
4WCY	Fab fragment of mouse AZ130 monoclonal antibody 分子名称: AZ130 Heavy chain, AZ130 Light chain, GLYCEROL, ... 著者 Fallecker, C, Tarbouriech, N, Habib, M, Crepin, T, Drouet, E. 登録日 2014-09-05 公開日 2015-09-23 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Fab fragment of mouse AZ130 monoclonal antibody To Be Published
4WD8	Crystal structure of a bacterial Bestrophin homolog from Klebsiella pneumoniae 分子名称: Bestrophin domain protein, ZINC ION 著者 Yang, T, Liu, Q, Hendrickson, W.A, New York Consortium on Membrane Protein Structure (NYCOMPS) 登録日 2014-09-08 公開日 2014-10-01 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Structure and selectivity in bestrophin ion channels. Science, 346, 2014
4V3Y	Structure of rat neuronal nitric oxide synthase heme domain in complex with N-2-(2-(1H-imidazol-1-yl)pyrimidin-4-yl)ethyl-3-(3- chlorophenyl)propan-1-amine 分子名称: 3-(3-chlorophenyl)-N-{2-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}propan-1-amine, 5,6,7,8-TETRAHYDROBIOPTERIN, ACETATE ION, ... 著者 Li, H, Poulos, T.L. 登録日 2014-10-20 公開日 2014-12-24 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (1.962 Å) 主引用文献 Novel 2,4-Disubstituted Pyrimidines as Potent, Selective, and Cell-Permeable Inhibitors of Neuronal Nitric Oxide Synthase. J.Med.Chem., 58, 2015
4UVW	Crystal structure of human tankyrase 2 in complex with 4,5-dimethyl-3- phenyl-1,2-dihydroisoquinolin-1-one 分子名称: 4,5-dimethyl-3-phenylisoquinolin-1(2H)-one, SULFATE ION, TANKYRASE-2, ... 著者 Haikarainen, T, Narwal, M, Lehtio, L. 登録日 2014-08-08 公開日 2015-07-29 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Exploration of the Nicotinamide-Binding Site of the Tankyrases, Identifying 3-Arylisoquinolin-1-Ones as Potent and Selective Inhibitors in Vitro. Bioorg.Med.Chem., 23, 2015
4UVN	Crystal structure of human tankyrase 2 in complex with 5-amino-3-(4- chlorophenyl)-1,2-dihydroisoquinolin-1-one 分子名称: 5-amino-3-(4-chlorophenyl)isoquinolin-1(2H)-one, GLYCEROL, SULFATE ION, ... 著者 Narwal, M, Haikarainen, T, Lehtio, L. 登録日 2014-08-07 公開日 2015-07-29 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Exploration of the Nicotinamide-Binding Site of the Tankyrases, Identifying 3-Arylisoquinolin-1-Ones as Potent and Selective Inhibitors in Vitro. Bioorg.Med.Chem., 23, 2015
4UV8	LSD1(KDM1A)-CoREST in complex with 1-Benzyl-Tranylcypromine 分子名称: LYSINE-SPECIFIC HISTONE DEMETHYLASE 1A, REST COREPRESSOR 1, [[(2R,3S,4S)-5-[(4aS,10aS)-4a-[(1S)-3-azanylidene-1,4-diphenyl-butyl]-7,8-dimethyl-2,4-bis(oxidanylidene)-5,10a-dihydro-1H-benzo[g]pteridin-10-yl]-2,3,4-tris(oxidanyl)pentoxy]-oxidanyl-phosphoryl] [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate 著者 Vianello, P, Botrugno, O, Cappa, A, Ciossani, G, Dessanti, P, Mai, A, Mattevi, A, Meroni, G, Minucci, S, Thaler, F, Tortorici, M, Trifiro, P, Valente, S, Villa, M, Varasi, M, Mercurio, C. 登録日 2014-08-05 公開日 2014-09-10 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Synthesis, Biological Activity and Mechanistic Insights of 1-Substituted Cyclopropylamine Derivatives: A Novel Class of Irreversible Inhibitors of Histone Demethylase Kdm1A. Eur.J.Med.Chem., 86C, 2014
4V2O	Structure of saposin B in complex with chloroquine 分子名称: N4-(7-CHLORO-QUINOLIN-4-YL)-N1,N1-DIETHYL-PENTANE-1,4-DIAMINE, SAPOSIN-B 著者 Zubieta, C, Lai, X, Doyle, R.P. 登録日 2014-10-13 公開日 2015-12-09 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (2.13 Å) 主引用文献 The Lysosomal Protein Saposin B Binds Chloroquine. Chemmedchem, 11, 2016
4UXT	Conserved mechanisms of microtubule-stimulated ADP release, ATP binding, and force generation in transport kinesins 分子名称: GUANOSINE-5'-DIPHOSPHATE, GUANOSINE-5'-TRIPHOSPHATE, KINESIN HEAVY CHAIN ISOFORM 5A, ... 著者 Atherton, J, Farabella, I, Yu, I.M, Rosenfeld, S.S, Houdusse, A, Topf, M, Moores, C. 登録日 2014-08-27 公開日 2014-09-24 最終更新日 2024-05-08 実験手法 ELECTRON MICROSCOPY (7.4 Å) 主引用文献 Conserved Mechanisms of Microtubule-Stimulated Adp Release, ATP Binding, and Force Generation in Transport Kinesins. Elife, 3, 2014
6QCB	Crystal structure of human cathepsin D in complex with macrocyclic inhibitor 9 分子名称: (3~{S},7~{S},8~{S})-7-oxidanyl-8-(phenylmethyl)-3-propan-2-yl-1,4,9-triazacyclohenicosane-2,5,10-trione, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, Cathepsin D, ... 著者 Brynda, J, Houstecka, R, Majer, P, Mares, M. 登録日 2018-12-27 公開日 2020-01-29 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.55 Å) 主引用文献 Biomimetic Macrocyclic Inhibitors of Human Cathepsin D: Structure-Activity Relationship and Binding Mode Analysis. J.Med.Chem., 63, 2020
6QD7	EM structure of a EBOV-GP bound to 3T0331 neutralizing antibody 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Envelope glycoprotein, Envelope glycoprotein,Virion spike glycoprotein,EBOV-GP1, ... 著者 Diskin, R, Cohen-Dvashi, H. 登録日 2019-01-01 公開日 2019-10-02 最終更新日 2024-10-16 実験手法 ELECTRON MICROSCOPY (3.1 Å) 主引用文献 Polyclonal and convergent antibody response to Ebola virus vaccine rVSV-ZEBOV. Nat. Med., 25, 2019
4W8P	Crystal structure of RIAM TBS1 in complex with talin R7R8 domains 分子名称: 1,2-ETHANEDIOL, Amyloid beta A4 precursor protein-binding family B member 1-interacting protein, Talin-1 著者 Chang, Y.C.E, Zhang, H, Wu, J. 登録日 2014-08-25 公開日 2014-12-03 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Structural and Mechanistic Insights into the Recruitment of Talin by RIAM in Integrin Signaling. Structure, 22, 2014
4W8S	Crystal structure of truncated hemolysin A Q125S/Y134S from P. mirabilis at 1.5 Angstroms resolution 分子名称: Hemolysin 著者 Novak, W.R.P, Glasgow, E, Thompson, J.R, Weaver, T.M. 登録日 2014-08-26 公開日 2015-10-07 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (1.511 Å) 主引用文献 Crystal structure of truncated hemolysin A Q125S/Y134S from P. mirabilis at 1.5 Angstroms resolution To Be Published
4W96	Crystal structure of cross-linked tetragonal hen egg white lysozyme soaked with 5mM [Ru(CO)3Cl2]2 followed by the reaction in deoxy-myoglobin solution 分子名称: CHLORIDE ION, DIMETHYLFORMAMIDE, Lysozyme C, ... 著者 Tabe, H, Fujita, K, Abe, S, Tsujimoto, M, Kuchimaru, T, Kizaka-Kondo, S, Takano, M, Kitagawa, S, Ueno, T. 登録日 2014-08-27 公開日 2014-12-31 最終更新日 2020-01-29 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Preparation of a Cross-Linked Porous Protein Crystal Containing Ru Carbonyl Complexes as a CO-Releasing Extracellular Scaffold Inorg.Chem., 54, 2015
4WAF	Crystal Structure of a novel tetrahydropyrazolo[1,5-a]pyrazine in an engineered PI3K alpha 分子名称: N,N-dimethyl-4-[(6R)-6-methyl-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazin-3-yl]benzenesulfonamide, Phosphatidylinositol 3-kinase regulatory subunit alpha, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform 著者 Knapp, M.S, Elling, R.A. 登録日 2014-08-29 公開日 2014-12-31 最終更新日 2023-09-27 実験手法 X-RAY DIFFRACTION (2.39 Å) 主引用文献 Structure-Based Drug Design of Novel Potent and Selective Tetrahydropyrazolo[1,5-a]pyrazines as ATR Inhibitors. Acs Med.Chem.Lett., 6, 2015
4WBB	Single Turnover Autophosphorylation Cycle of the PKA RIIb Holoenzyme 分子名称: ADENOSINE-5'-DIPHOSPHATE, CALCIUM ION, cAMP-dependent protein kinase catalytic subunit alpha, ... 著者 Zhang, P, Knape, M.J, Ahuja, L.G, Keshwani, M.M, King, C.C, Sastri, M, Herberg, F.W, Taylor, S.S. 登録日 2014-09-02 公開日 2015-05-20 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (2.8 Å) 主引用文献 Single Turnover Autophosphorylation Cycle of the PKA RII beta Holoenzyme. Plos Biol., 13, 2015
4WC8	Heterogeneous dodecamer formed from macrocycles containing a sequence from beta-2-microglobulin(63-69). 分子名称: CHLORIDE ION, ORN-TYR-LEU-LEU-PHI-TYR-THR-GLU-ORN-LYS-VAL-ALA-MAA-ALA-VAL-LYS, ORN-TYR-LEU-LEU-PHI-TYR-THR-GLU-ORN-LYS-VAL-ALA-MLE-ALA-VAL-LYS, ... 著者 Spencer, R.K, Nowick, J.S. 登録日 2014-09-04 公開日 2015-05-06 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.908 Å) 主引用文献 X-ray Crystallographic Structures of Oligomers of Peptides Derived from beta 2-Microglobulin. J.Am.Chem.Soc., 137, 2015
4WDT	17beta-HSD5 in complex with 2-nitro-5-(phenylsulfonyl)phenol 分子名称: 2-nitro-5-(phenylsulfonyl)phenol, Aldo-keto reductase family 1 member C3, NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE 著者 Amano, Y, Yamaguchi, T. 登録日 2014-09-09 公開日 2015-04-15 最終更新日 2024-06-26 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Structures of complexes of type 5 17 beta-hydroxysteroid dehydrogenase with structurally diverse inhibitors: insights into the conformational changes upon inhibitor binding. Acta Crystallogr.,Sect.D, 71, 2015
4WDY	JC Polyomavirus VP1 five-fold pore mutant N221Q 分子名称: 1,2-ETHANEDIOL, GLYCEROL, Major capsid protein VP1 著者 Stroh, L.J, Stehle, T. 登録日 2014-09-09 公開日 2015-02-18 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Modulation of a Pore in the Capsid of JC Polyomavirus Reduces Infectivity and Prevents Exposure of the Minor Capsid Proteins. J.Virol., 89, 2015
4UT1	The structure of the flagellar hook junction protein FlgK from Burkholderia pseudomallei 分子名称: 1,2-ETHANEDIOL, FLAGELLAR HOOK-ASSOCIATED PROTEIN 著者 Gourlay, L.J, Lassaux, P, Bolognesi, M. 登録日 2014-07-17 公開日 2015-02-11 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 From Crystal Structure to in Silico Epitope Discovery in Burkholderia Pseudomallei Flagellar Hook-Associated Protein Flgk. FEBS J., 282, 2015
4V3V	Structure of rat neuronal nitric oxide synthase heme domain in complex with N-(2-(1H-imidazol-1-yl)-4-pyrimidylmethyl)-3-(3- fluorophenyl)propan-1-amine 分子名称: 3-(3-fluorophenyl)-N-{[2-(1H-imidazol-1-yl)pyrimidin-4-yl]methyl}propan-1-amine, 5,6,7,8-TETRAHYDROBIOPTERIN, ACETATE ION, ... 著者 Li, H, Poulos, T.L. 登録日 2014-10-20 公開日 2014-12-24 最終更新日 2024-05-08 実験手法 X-RAY DIFFRACTION (2.06 Å) 主引用文献 Novel 2,4-Disubstituted Pyrimidines as Potent, Selective, and Cell-Permeable Inhibitors of Neuronal Nitric Oxide Synthase. J.Med.Chem., 58, 2015

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