PDB: 71589 件ウェブページステータス検索Chemie searchBIRD

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4QBN	VRR_NUC domain 分子名称: Nuclease, SULFATE ION 著者 Smerdon, S.J, Pennell, S, Li, J. 登録日 2014-05-08 公開日 2014-09-10 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.85 Å) 主引用文献 FAN1 activity on asymmetric repair intermediates is mediated by an atypical monomeric virus-type replication-repair nuclease domain. Cell Rep, 8, 2014
8JJO	Cryo-EM structure of the beta2AR-mBRIL/1b3 Fab/Glue complex with an antagonist 分子名称: (2S)-1-[(1-methylethyl)amino]-3-(2-prop-2-en-1-ylphenoxy)propan-2-ol, Beta-2 adrenergic receptor,Beta-2 adrenergic receptor,Soluble cytochrome b562 著者 He, B.B, Zhong, Y.X, Guo, Q, Tao, Y.Y. 登録日 2023-05-31 公開日 2023-09-06 最終更新日 2024-01-03 実験手法 ELECTRON MICROSCOPY (3.4 Å) 主引用文献 A method for structure determination of GPCRs in various states. Nat.Chem.Biol., 20, 2024
4PX3	Human GKRP bound to AMG-3295 and Sorbitol-6-phosphate 分子名称: D-SORBITOL-6-PHOSPHATE, GLYCEROL, Glucokinase regulatory protein, ... 著者 Jordan, S.R, Chmait, S. 登録日 2014-03-21 公開日 2015-05-13 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.43 Å) 主引用文献 Discovery and Structure-Guided Optimization of Diarylmethanesulfonamide Disruptors of GK-GKRP Binding To be Published
4Q4X	Crystal structure of Coxsackievirus A24v soaked with 6'-Sialyllactose (6SL) 分子名称: CALCIUM ION, CHLORIDE ION, Coxsackievirus capsid protein VP1, ... 著者 Zocher, G, Stehle, T. 登録日 2014-04-15 公開日 2014-11-05 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 A sialic Acid binding site in a human picornavirus. Plos Pathog., 10, 2014
4Q6R	Crystal structure of human sphingosine-1-phosphate lyase in complex with inhibitor 6-[(2R)-4-(4-benzyl-7-chlorophthalazin-1-yl)-2-methylpiperazin-1-yl]pyridine-3-carbonitrile 分子名称: 6-[(2R)-4-(4-benzyl-7-chlorophthalazin-1-yl)-2-methylpiperazin-1-yl]pyridine-3-carbonitrile, GLYCEROL, PHOSPHATE ION, ... 著者 Srinivas, H. 登録日 2014-04-23 公開日 2014-05-21 最終更新日 2023-12-06 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Orally Active 7-Substituted (4-Benzylphthalazin-1-yl)-2-methylpiperazin-1-yl]nicotinonitriles as Active-Site Inhibitors of Sphingosine 1-Phosphate Lyase for the Treatment of Multiple Sclerosis. J.Med.Chem., 57, 2014
4QEW	Crystal structure of BRD2(BD2) mutant with ligand ET bound (METHYL (2R)- 2-[(4S)-6-(4-CHLOROPHENYL)-8-METHOXY-1-METHYL-4H-[1,2,4]TRIAZOLO[4,3-A][1, 4]BENZODIAZEPIN-4-YL]BUTANOATE) 分子名称: Bromodomain-containing protein 2, GLYCEROL, NICKEL (II) ION, ... 著者 Tallant, C, Baud, M, Lin-Shiao, E, Chirgadze, D.Y, Ciulli, A. 登録日 2014-05-19 公開日 2014-10-29 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Chemical biology. A bump-and-hole approach to engineer controlled selectivity of BET bromodomain chemical probes. Science, 346, 2014
4Q4Y	Crystal structure of Coxsackievirus A24v soaked with Disialyllacto-N-tetraose (DSLNT) 分子名称: CALCIUM ION, CHLORIDE ION, Coxsackievirus capsid protein VP1, ... 著者 Zocher, G, Stehle, T. 登録日 2014-04-15 公開日 2014-11-05 最終更新日 2020-07-29 実験手法 X-RAY DIFFRACTION (1.88 Å) 主引用文献 A sialic Acid binding site in a human picornavirus. Plos Pathog., 10, 2014
4QO4	co-crystal structure of MDM2 (17-111) with compound 16, {(3R,5R,6S)-5-(3-CHLOROPHENYL)-6-(4-CHLOROPHENYL)-1-[(1S)-1-(6-CYCLOPROPYLPYRIDIN-2-YL)PROPYL]-3-METHYL-2-OXOPIPERIDIN-3-YL}ACETIC ACID 分子名称: E3 ubiquitin-protein ligase Mdm2, {(3R,5R,6S)-5-(3-chlorophenyl)-6-(4-chlorophenyl)-1-[(1S)-1-(6-cyclopropylpyridin-2-yl)propyl]-3-methyl-2-oxopiperidin-3-yl}acetic acid 著者 Huang, X. 登録日 2014-06-19 公開日 2014-07-16 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Discovery of Potent and Simplified Piperidinone-Based Inhibitors of the MDM2-p53 Interaction. ACS Med Chem Lett, 5, 2014
4QEV	Crystal structure of BRD2(BD2) mutant with ligand ME bound (METHYL (2R)- 2-[(4S)-6-(4-CHLOROPHENYL)-8-METHOXY-1-METHYL-4H-[1,2,4]TRIAZOLO[4,3-A][1, 4]BENZODIAZEPIN-4-YL]PROPANOATE) 分子名称: Bromodomain-containing protein 2, GLYCEROL, NICKEL (II) ION, ... 著者 Tallant, C, Baud, M, Lin-Shiao, E, Chirgadze, D.Y, Ciulli, A. 登録日 2014-05-19 公開日 2014-10-29 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Chemical biology. A bump-and-hole approach to engineer controlled selectivity of BET bromodomain chemical probes. Science, 346, 2014
4QKW	Crystal structure of the zebrafish cavin4a HR1 domain 分子名称: CHLORIDE ION, Muscle-related coiled-coil protein 著者 Kovtun, O, Tillu, V, Parton, R.G, Collins, B.M. 登録日 2014-06-10 公開日 2015-03-18 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Structural insights into the organization of the cavin membrane coat complex Dev.Cell, 31, 2014
4QBO	VRR_NUC domain 分子名称: MAGNESIUM ION, Nuclease 著者 Smerdon, S.J, Pennell, S, Li, J. 登録日 2014-05-08 公開日 2014-09-10 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.3 Å) 主引用文献 FAN1 activity on asymmetric repair intermediates is mediated by an atypical monomeric virus-type replication-repair nuclease domain. Cell Rep, 8, 2014
4QCI	PDGF-B blocking antibody bound to PDGF-BB 分子名称: Platelet-derived growth factor subunit B, anti-PDGF-BB antibody - Light Chain, anti-PDGF-BB antibody - Heavy chain 著者 Kuai, J, Mosyak, L, Tam, M, LaVallie, E, Pullen, N, Carven, G. 登録日 2014-05-12 公開日 2015-03-11 最終更新日 2024-03-06 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Characterization of Binding Mode of Action of a Blocking Anti-Platelet-Derived Growth Factor (PDGF)-B Monoclonal Antibody, MOR8457, Reveals Conformational Flexibility and Avidity Needed for PDGF-BB To Bind PDGF Receptor-beta. Biochemistry, 54, 2015
4QVX	Discovery of a Potent and Selective BCL-XL Inhibitor That Demonstrates Thrombocytopenia and Inhibits Tumor Growth in Vivo 分子名称: 2-[8-(1,3-benzothiazol-2-ylcarbamoyl)-3,4-dihydroisoquinolin-2(1H)-yl]-5-(3-{4-[3-(dimethylamino)prop-1-yn-1-yl]-2-fluorophenoxy}propyl)-1,3-thiazole-4-carboxylic acid, Bcl-2-like protein 1 著者 Park, C.H. 登録日 2014-07-16 公開日 2015-07-22 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Discovery of a Potent and Selective BCL-XL Inhibitor with in Vivo Activity. ACS MED.CHEM.LETT., 5, 2014
4R6A	Crystal structure of human TLR8 in complex with Hybrid-2 分子名称: 1-(4-amino-2-butyl-1H-imidazo[4,5-c]quinolin-1-yl)-2-methylpropan-2-ol, 2-acetamido-2-deoxy-beta-D-glucopyranose, Toll-like receptor 8, ... 著者 Tanji, H, Ohto, U, Shimizu, T. 登録日 2014-08-22 公開日 2015-08-26 最終更新日 2020-07-29 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Hybrid-2: AnImidazoquinoline Dual Toll-like receptor 7/8 Agonist that Potently Activates Cytokine Production by Human Newborn and Adult Leukocytes To be Published
4R7H	Crystal structure of FMS KINASE domain with a small molecular inhibitor, PLX3397 分子名称: 5-[(5-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-N-{[6-(trifluoromethyl)pyridin-3-yl]methyl}pyridin-2-amine, Macrophage colony-stimulating factor 1 receptor 著者 Zhang, Y, Zhang, K, Zhang, C. 登録日 2014-08-27 公開日 2015-08-12 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.8001 Å) 主引用文献 Structure-Guided Blockade of CSF1R Kinase in Tenosynovial Giant-Cell Tumor. N Engl J Med, 373, 2015
4YTN	Crystal structure of Mitochondrial rhodoquinol-fumarate reductase from Ascaris suum with N-[3-(pentafluorophenoxy)phenyl]-2-(trifluoromethyl)benzamide 分子名称: Cytochrome b-large subunit, FE2/S2 (INORGANIC) CLUSTER, FE3-S4 CLUSTER, ... 著者 Harada, S, Shiba, T, Sato, D, Yamamoto, A, Nagahama, M, Yone, A, Inaoka, D.K, Sakamoto, K, Inoue, M, Honma, T, Kita, K. 登録日 2015-03-18 公開日 2015-08-05 最終更新日 2023-11-08 実験手法 X-RAY DIFFRACTION (3 Å) 主引用文献 New Insights into the Design of Inhibitors Targeted for Parasitic Anaerobic Energy Metabolism To Be Published
4R7I	Crystal structure of FMS kinase domain with a small molecular inhibitor, GLEEVEC 分子名称: 4-(4-METHYL-PIPERAZIN-1-YLMETHYL)-N-[4-METHYL-3-(4-PYRIDIN-3-YL-PYRIMIDIN-2-YLAMINO)-PHENYL]-BENZAMIDE, Macrophage colony-stimulating factor 1 receptor 著者 Zhang, Y, Zhang, C. 登録日 2014-08-27 公開日 2015-08-12 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (2.75 Å) 主引用文献 Structure-Guided Blockade of CSF1R Kinase in Tenosynovial Giant-Cell Tumor. N Engl J Med, 373, 2015
4R8U	S-SAD structure of DINB-DNA Complex 分子名称: 5'-O-[(R)-hydroxy{[(R)-hydroxy(phosphonooxy)phosphoryl]amino}phosphoryl]thymidine, DNA, DNA polymerase IV, ... 著者 Kottur, J, Nair, D.T, Weinert, T, Oligeric, V, Wang, M. 登録日 2014-09-03 公開日 2015-01-14 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Fast native-SAD phasing for routine macromolecular structure determination Nat.Methods, 12, 2015
4R8T	Structure of JEV protease 分子名称: CHLORIDE ION, NS3, Serine protease subunit NS2B 著者 Nair, D.T, Weinert, T, Wang, M, Olieric, V. 登録日 2014-09-03 公開日 2014-12-24 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (2.133 Å) 主引用文献 Fast native-SAD phasing for routine macromolecular structure determination. Nat.Methods, 12, 2015
5FLK	Structure of haloalkane dehalogenase variant DhaA101 分子名称: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID, DHAA101, DI(HYDROXYETHYL)ETHER 著者 Chaloupkova, R, Waterman, J, Damborsky, J. 登録日 2015-10-26 公開日 2017-03-29 最終更新日 2024-01-10 実験手法 X-RAY DIFFRACTION (0.99 Å) 主引用文献 Evolutionary Analysis is a Powerful Complement to Energy Calculations Allowing Entropy-Driven Stabilization To be Published
4R5N	8-Tetrahydropyran-2-yl chromans: highly selective beta-site amyloid precursor protein cleaving enzyme 1 (BACE1) inhibitors 分子名称: (4R,4a'S,10a'R)-8'-(2-fluoropyridin-3-yl)-4a'-methyl-3',4',4a',10a'-tetrahydro-2'H-spiro[1,3-oxazole-4,10'-pyrano[3,2-b]chromen]-2-amine, Beta-secretase 1, NICKEL (II) ION 著者 Vigers, G.P.A, Smith, D. 登録日 2014-08-21 公開日 2014-12-03 最終更新日 2023-09-20 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 8-Tetrahydropyran-2-yl Chromans: Highly Selective Beta-Site Amyloid Precursor Protein Cleaving Enzyme 1 (BACE1) Inhibitors. J.Med.Chem., 57, 2014
4RHF	Crystal structure of UbiX mutant V47S from Colwellia psychrerythraea 34H 分子名称: 3-octaprenyl-4-hydroxybenzoate carboxy-lyase, SULFATE ION 著者 Do, H, Kim, S.J, Lee, C.W, Kim, H.-W, Park, H.H, Kim, H.M, Park, H, Park, H.J, Lee, J.H. 登録日 2014-10-02 公開日 2015-02-18 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (1.764 Å) 主引用文献 Crystal structure of UbiX, an aromatic acid decarboxylase from the psychrophilic bacterium Colwellia psychrerythraea that undergoes FMN-induced conformational changes. Sci Rep, 5, 2015
4RHE	Crystal structure of UbiX, an aromatic acid decarboxylase from the Colwellia psychrerythraea 34H 分子名称: 3-octaprenyl-4-hydroxybenzoate carboxy-lyase, FLAVIN MONONUCLEOTIDE, SULFATE ION 著者 Do, H, Kim, S.J, Lee, C.W, Kim, H.-W, Park, H.H, Kim, H.M, Park, H, Park, H.J, Lee, J.H. 登録日 2014-10-02 公開日 2015-02-18 最終更新日 2024-02-28 実験手法 X-RAY DIFFRACTION (2.003 Å) 主引用文献 Crystal structure of UbiX, an aromatic acid decarboxylase from the psychrophilic bacterium Colwellia psychrerythraea that undergoes FMN-induced conformational changes. Sci Rep, 5, 2015
4RYD	X-ray structure of human furin in complex with the competitive inhibitor para-guanidinomethyl-Phac-R-Tle-R-Amba 分子名称: CALCIUM ION, FORMIC ACID, Furin, ... 著者 Dahms, S.O, Than, M.E. 登録日 2014-12-15 公開日 2015-05-27 最終更新日 2024-07-10 実験手法 X-RAY DIFFRACTION (2.15 Å) 主引用文献 Novel Furin Inhibitors with Potent Anti-infectious Activity. Chemmedchem, 10, 2015
4TOT	Crystal structure of rat cyclophilin D in complex with a potent nonimmunosuppressive inhibitor 分子名称: HEXAETHYLENE GLYCOL, Peptidyl-prolyl cis-trans isomerase F, mitochondrial, ... 著者 Knapp, M.S, Elling, R.A. 登録日 2014-06-06 公開日 2014-11-12 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.39 Å) 主引用文献 Potent nonimmunosuppressive cyclophilin inhibitors with improved pharmaceutical properties and decreased transporter inhibition. J.Med.Chem., 57, 2014

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