PDB: 5495 件ウェブページステータス検索Chemie searchBIRD

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8OOG	Crystal structure of human MAT2a with S-Adenosylmethionine and a fragment bound in a novel pocket 分子名称: 6-oxidanyl-1,3-benzoxathiol-2-one, DIMETHYL SULFOXIDE, S-ADENOSYLMETHIONINE, ... 著者 Schimpl, M. 登録日 2023-04-05 公開日 2023-07-12 最終更新日 2024-06-19 実験手法 X-RAY DIFFRACTION (1.384 Å) 主引用文献 Combining structural and coevolution information to unveil allosteric sites. Chem Sci, 14, 2023
6FCN	Crystal structure of human PCNA soaked with p47phox(106-127) peptide 分子名称: Proliferating cell nuclear antigen 著者 Housset, D, Frachet, P. 登録日 2017-12-20 公開日 2019-01-30 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (3.22 Å) 主引用文献 Cytosolic PCNA interacts with p47phox and controls NADPH oxidase NOX2 activation in neutrophils. J.Exp.Med., 216, 2019
7JS8	STRUCTURE OF HUMAN HDAC2 IN COMPLEX WITH AN ETHYL KETONE INHIBITOR CONTAINING A SPIRO-BICYCLIC GROUP (COMPOUND 22) 分子名称: (1S)-N-{(1S)-7,7-dihydroxy-1-[4-(2-methylquinolin-6-yl)-1H-imidazol-2-yl]nonyl}-6-methyl-6-azaspiro[2.5]octane-1-carboxamide, CALCIUM ION, DI(HYDROXYETHYL)ETHER, ... 著者 Klein, D.J, Yu, W. 登録日 2020-08-14 公開日 2021-08-11 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.634 Å) 主引用文献 Discovery of Ethyl Ketone-Based Highly Selective HDACs 1, 2, 3 Inhibitors for HIV Latency Reactivation with Minimum Cellular Potency Serum Shift and Reduced hERG Activity. J.Med.Chem., 64, 2021
8A6L	Human 4F2hc-LAT2 heterodimeric amino acid transporter in complex with anticalin D11vs 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 4F2hc cell-surface antigen heavy chain, Anticalin D11vs, ... 著者 Jeckelmann, J.M, Fotiadis, D. 登録日 2022-06-18 公開日 2022-11-09 実験手法 ELECTRON MICROSCOPY (3.18 Å) 主引用文献 Structure of the human heterodimeric transporter 4F2hc-LAT2 in complex with Anticalin, an alternative binding protein for applications in single-particle cryo-EM. Sci Rep, 12, 2022
2JC6	Crystal structure of human calmodulin-dependent protein kinase 1D 分子名称: CALCIUM/CALMODULIN-DEPENDENT PROTEIN KINASE TYPE 1D, N-(5-METHYL-1H-PYRAZOL-3-YL)-2-PHENYLQUINAZOLIN-4-AMINE 著者 Debreczeni, J.E, Rellos, P, Fedorov, O, Niesen, F.H, Bhatia, C, Shrestha, L, Salah, E, Smee, C, Colebrook, S, Berridge, G, Gileadi, O, Bunkoczi, G, Ugochukwu, E, Pike, A.C.W, von Delft, F, Knapp, S, Sundstrom, M, Weigelt, J, Arrowsmith, C.H, Edwards, A. 登録日 2006-12-19 公開日 2007-02-13 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Crystal Structure of Human Calmodulin-Dependent Protein Kinase 1D To be Published
2JHV	CRYSTAL STRUCTURE OF RHOGDI E154A,E155A MUTANT 分子名称: RHO GDP-DISSOCIATION INHIBITOR 1 著者 Cooper, D.R, Pinkowska, M, Derewenda, Z.S. 登録日 2007-02-23 公開日 2007-05-08 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (2.07 Å) 主引用文献 Protein Crystallization by Surface Entropy Reduction: Optimization of the Ser Strategy Acta Crystallogr.,Sect.D, 63, 2007
5YQX	Crystal Structure Analysis of the BRD4 分子名称: (2R)-2-(cyclopropylmethyl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-4H-1,4-benzoxazin-3-one, 1,2-ETHANEDIOL, Bromodomain-containing protein 4, ... 著者 Xue, X, Zhang, Y, Wang, C, Song, M. 登録日 2017-11-08 公開日 2018-11-28 最終更新日 2024-03-27 実験手法 X-RAY DIFFRACTION (1.82 Å) 主引用文献 Benzoxazinone-containing 3,5-dimethylisoxazole derivatives as BET bromodomain inhibitors for treatment of castration-resistant prostate cancer. Eur.J.Med.Chem., 152, 2018
7ZN7	Cryo-EM structure of RCMV-E E27 bound to human DDB1 (deltaBPB) and rat STAT2 CCD 分子名称: B27a, DNA damage-binding protein 1, Signal transducer and activator of transcription, ... 著者 Lauer, S, Spahn, C.M.T, Schwefel, D. 登録日 2022-04-20 公開日 2022-11-09 最終更新日 2024-07-24 実験手法 ELECTRON MICROSCOPY (3.78 Å) 主引用文献 Structural mechanism of CRL4-instructed STAT2 degradation via a novel cytomegaloviral DCAF receptor. Embo J., 42, 2023
7ZNN	Cryo-EM structure of RCMV-E E27 bound to human DDB1 (deltaBPB) and full-length rat STAT2 分子名称: B27a, DNA damage-binding protein 1, Signal transducer and activator of transcription, ... 著者 Lauer, S, Spahn, C.M.T, Schwefel, D. 登録日 2022-04-21 公開日 2022-11-09 最終更新日 2024-07-24 実験手法 ELECTRON MICROSCOPY (4.8 Å) 主引用文献 Structural mechanism of CRL4-instructed STAT2 degradation via a novel cytomegaloviral DCAF receptor. Embo J., 42, 2023
8QE0	Crystal structure of human MAT2a bound to S-Adenosylmethionine and Compound 12 分子名称: 4-[4-[bis(fluoranyl)methoxy]phenyl]-3-cyclopropyl-2~{H}-pyrazolo[4,3-b]pyridin-5-one, S-ADENOSYLMETHIONINE, S-adenosylmethionine synthase isoform type-2 著者 Schimpl, M. 登録日 2023-08-30 公開日 2024-03-20 最終更新日 2024-04-10 実験手法 X-RAY DIFFRACTION (1.12 Å) 主引用文献 Development of a Series of Pyrrolopyridone MAT2A Inhibitors. J.Med.Chem., 67, 2024
5YJB	LSD1-CoREST in complex with 4-[5-(piperidin-4-ylmethoxy)-2-(p-tolyl)pyridin-3-yl]benzonitrile 分子名称: 4-[2-(4-methylphenyl)-5-(piperidin-4-ylmethoxy)pyridin-3-yl]benzenecarbonitrile, FLAVIN-ADENINE DINUCLEOTIDE, GLYCEROL, ... 著者 Niwa, H, Sato, S, Hashimoto, T, Matsuno, K, Umehara, T. 登録日 2017-10-10 公開日 2018-07-04 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.96 Å) 主引用文献 Crystal Structure of LSD1 in Complex with 4-[5-(Piperidin-4-ylmethoxy)-2-(p-tolyl)pyridin-3-yl]benzonitrile. Molecules, 23, 2018
8QE2	Crystal structure of human MAT2a bound to S-Adenosylmethionine and Compound 21 分子名称: 4-[4-[bis(fluoranyl)methoxy]phenyl]-3-cyclopropyl-6-(2-methylindazol-5-yl)-2~{H}-pyrazolo[4,3-b]pyridin-5-one, S-ADENOSYLMETHIONINE, S-adenosylmethionine synthase isoform type-2 著者 Schimpl, M. 登録日 2023-08-30 公開日 2024-03-20 最終更新日 2024-04-10 実験手法 X-RAY DIFFRACTION (1.109 Å) 主引用文献 Development of a Series of Pyrrolopyridone MAT2A Inhibitors. J.Med.Chem., 67, 2024
8QE3	Crystal structure of human MAT2a bound to S-Adenosylmethionine and Compound 31 分子名称: 3-cyclopropyl-6-(2-methylindazol-5-yl)-4-(6-methylpyridin-3-yl)-2~{H}-pyrazolo[4,3-b]pyridin-5-one, S-ADENOSYLMETHIONINE, S-adenosylmethionine synthase isoform type-2 著者 Schimpl, M. 登録日 2023-08-30 公開日 2024-03-20 最終更新日 2024-04-10 実験手法 X-RAY DIFFRACTION (1.089 Å) 主引用文献 Development of a Series of Pyrrolopyridone MAT2A Inhibitors. J.Med.Chem., 67, 2024
6FAJ	The structure of Human Methionine Adenosyltransferase II in apo state 分子名称: ACETATE ION, DI(HYDROXYETHYL)ETHER, S-adenosylmethionine synthase isoform type-2, ... 著者 Bradley-Clarke, J, Panmanee, J, Antonyuk, S.V, Hasnain, S.S. 登録日 2017-12-15 公開日 2019-02-06 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Control and regulation of S-Adenosylmethionine biosynthesis by the regulatory beta subunit and quinolone-based compounds Febs J., 2020
6FBO	Human Methionine Adenosyltransferase II mutant (S114A) in I222 crystal form 分子名称: (DIPHOSPHONO)AMINOPHOSPHONIC ACID, 1,2-ETHANEDIOL, ADENOSINE, ... 著者 Panmanee, J, Antonyuk, S.V, Hasnain, S.S. 登録日 2017-12-19 公開日 2019-01-30 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (1.8 Å) 主引用文献 Control and regulation of S-Adenosylmethionine biosynthesis by the regulatory beta subunit and quinolone-based compounds. Febs J., 286, 2019
8QE1	Crystal structure of human MAT2a bound to S-Adenosylmethionine and Compound 15 分子名称: 4-[4-[bis(fluoranyl)methoxy]phenyl]-3-cyclopropyl-6-(4-methoxyphenyl)-2~{H}-pyrazolo[4,3-b]pyridin-5-one, S-ADENOSYLMETHIONINE, S-adenosylmethionine synthase isoform type-2 著者 Schimpl, M. 登録日 2023-08-30 公開日 2024-03-20 最終更新日 2024-04-10 実験手法 X-RAY DIFFRACTION (1.095 Å) 主引用文献 Development of a Series of Pyrrolopyridone MAT2A Inhibitors. J.Med.Chem., 67, 2024
5Y8V	Crystal structure of GAS41 分子名称: MAGNESIUM ION, YEATS domain-containing protein 4 著者 Wang, Y, Hao, Q. 登録日 2017-08-21 公開日 2018-04-25 最終更新日 2023-11-22 実験手法 X-RAY DIFFRACTION (2.61 Å) 主引用文献 Identification of the YEATS domain of GAS41 as a pH-dependent reader of histone succinylation Proc. Natl. Acad. Sci. U.S.A., 115, 2018
8RGG	Structure of dynein-2 intermediate chain DYNC2I2 (WDR34) in complex with dynein-2 heavy chain DYNC2H1. 分子名称: Cytoplasmic dynein 2 intermediate chain 1, Cytoplasmic dynein 2 intermediate chain 2, Dynein light chain 1, ... 著者 Mukhopadhyay, A.G, Toropova, K, Daly, L, Wells, J, Vuolo, L, Mladenov, M, Seda, M, Jenkins, D, Stephens, D.J, Roberts, A.J. 登録日 2023-12-13 公開日 2024-03-20 最終更新日 2024-04-10 実験手法 ELECTRON MICROSCOPY (4 Å) 主引用文献 Structure and tethering mechanism of dynein-2 intermediate chains in intraflagellar transport. Embo J., 43, 2024
2JI0	CRYSTAL STRUCTURE OF RHOGDI K138Y, K141Y MUTANT 分子名称: RHO GDP-DISSOCIATION INHIBITOR 1, SULFATE ION 著者 Cooper, D.R, Boczek, T, Derewenda, Z.S. 登録日 2007-02-23 公開日 2007-05-08 最終更新日 2023-12-13 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Protein Crystallization by Surface Entropy Reduction: Optimization of the Ser Strategy Acta Crystallogr.,Sect.D, 63, 2007
7ZFS	BRD4 in complex with FragLite32 分子名称: 1,2-ETHANEDIOL, 4-bromanyl-1,2-dimethoxy-benzene, Bromodomain-containing protein 4, ... 著者 Turberville, S, Martin, M.P, Hope, I, Noble, M.E.M. 登録日 2022-04-01 公開日 2022-11-23 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.25 Å) 主引用文献 Mapping Ligand Interactions of Bromodomains BRD4 and ATAD2 with FragLites and PepLites─Halogenated Probes of Druglike and Peptide-like Molecular Interactions. J.Med.Chem., 65, 2022
7ZFZ	BRD4 in complex with PepLite-Val 分子名称: (2R)-2-acetamido-N-(3-bromanylprop-2-ynyl)-3-methyl-butanamide, Bromodomain-containing protein 4, GLYCEROL 著者 Turberville, S, Martin, M.P, Hope, I, Noble, M.E.M. 登録日 2022-04-01 公開日 2022-11-23 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.08 Å) 主引用文献 Mapping Ligand Interactions of Bromodomains BRD4 and ATAD2 with FragLites and PepLites─Halogenated Probes of Druglike and Peptide-like Molecular Interactions. J.Med.Chem., 65, 2022
8QDZ	Crystal structure of human MAT2a bound to S-Adenosylmethionine and Compound 11 分子名称: 3-cyclopropyl-4-(4-methoxyphenyl)-5-oxidanyl-pyrazolo[4,3-c]pyridine, S-ADENOSYLMETHIONINE, S-adenosylmethionine synthase isoform type-2 著者 Schimpl, M. 登録日 2023-08-30 公開日 2024-03-20 最終更新日 2024-04-10 実験手法 X-RAY DIFFRACTION (1.16 Å) 主引用文献 Development of a Series of Pyrrolopyridone MAT2A Inhibitors. J.Med.Chem., 67, 2024
7JZT	Low resolution crystal structure of Zaire Ebola virus VP40 in space group P6422 分子名称: Matrix protein VP40 著者 Norris, M.J, Bornholdt, Z.A, Saphire, E.O. 登録日 2020-09-02 公開日 2020-10-21 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.77 Å) 主引用文献 Ebola and Marburg virus matrix layers are locally ordered assemblies of VP40 dimers. Elife, 9, 2020
7ZFV	BRD4 in complex with PepLite-Ala 分子名称: (2~{S})-2-acetamido-~{N}-(3-bromanylprop-2-ynyl)propanamide, Bromodomain-containing protein 4, GLYCEROL 著者 Turberville, S, Martin, M.P, Hope, I, Noble, M.E.M. 登録日 2022-04-01 公開日 2022-11-23 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.37 Å) 主引用文献 Mapping Ligand Interactions of Bromodomains BRD4 and ATAD2 with FragLites and PepLites─Halogenated Probes of Druglike and Peptide-like Molecular Interactions. J.Med.Chem., 65, 2022
7ZFY	BRD4 in complex with PepLite-Gly 分子名称: 2-acetamido-N-(3-bromanylprop-2-ynyl)ethanamide, Bromodomain-containing protein 4, GLYCEROL 著者 Turberville, S, Martin, M.P, Hope, I, Noble, M.E.M. 登録日 2022-04-01 公開日 2022-11-23 最終更新日 2024-01-31 実験手法 X-RAY DIFFRACTION (1.15 Å) 主引用文献 Mapping Ligand Interactions of Bromodomains BRD4 and ATAD2 with FragLites and PepLites─Halogenated Probes of Druglike and Peptide-like Molecular Interactions. J.Med.Chem., 65, 2022

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