PDB: 234 件ウェブページステータス検索Chemie searchBIRD

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6W9E	Crystal Structure of Human CDK9/cyclinT1 in complex with MC180295 分子名称: (4-amino-2-{[(1R,2R,4S)-bicyclo[2.2.1]heptan-2-yl]amino}-1,3-thiazol-5-yl)(2-nitrophenyl)methanone, (4-amino-2-{[(1S,2S,4R)-bicyclo[2.2.1]heptan-2-yl]amino}-1,3-thiazol-5-yl)(2-nitrophenyl)methanone, Cyclin-T1, ... 著者 Zhang, P, Wu, J. 登録日 2020-03-22 公開日 2021-09-01 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.1 Å) 主引用文献 Comparative Modeling of CDK9 Inhibitors to Explore Selectivity and Structure-Activity Relationships To Be Published
7KPY	Crystal structure of CBP bromodomain liganded with UMB298 (compound 23) 分子名称: 1,2-ETHANEDIOL, 2-[2-(3-chloranyl-4-methoxy-phenyl)ethyl]-~{N}-cyclohexyl-7-(3,5-dimethyl-1,2-oxazol-4-yl)imidazo[1,2-a]pyridin-3-amine, Histone acetyltransferase 著者 Schonbrunn, E, Bikowitz, M. 登録日 2020-11-12 公開日 2021-05-19 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 Development of Dimethylisoxazole-Attached Imidazo[1,2- a ]pyridines as Potent and Selective CBP/P300 Inhibitors. J.Med.Chem., 64, 2021
7LUO	N-terminus of Skp2 bound to Cyclin A 分子名称: S-phase kinase-associated protein 2,Cyclin-A2, Skp2 Motif 1 uncharacterized fragment 1, Skp2 Motif 1 uncharacterized fragment 2 著者 Kelso, S, Ceccarelli, D.F, Sicheri, F. 登録日 2021-02-22 公開日 2021-05-12 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (3.17 Å) 主引用文献 Bipartite binding of the N terminus of Skp2 to cyclin A. Structure, 29, 2021
7LJE	Discovery of Spirohydantoins as Selective, Orally Bioavailable Inhibitors of p300/CBP Histone Acetyltransferases 分子名称: 2-[4-[(3'R,4S)-3'-fluoro-1-[2-[(4-fluorophenyl)methyl-[(1S)-2,2,2-trifluoro-1-methyl-ethyl]amino]-2-oxo-ethyl]-2,5-dioxo-spiro[imidazolidine-4,1'-indane]-5'-yl]pyrazol-1-yl]-N-methyl-acetamide, Histone acetyltransferase p300 著者 Jakob, C.G. 登録日 2021-01-29 公開日 2021-03-17 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.607 Å) 主引用文献 Discovery of spirohydantoins as selective, orally bioavailable inhibitors of p300/CBP histone acetyltransferases. Bioorg.Med.Chem.Lett., 39, 2021
7CD5	mAPE1-blunt-ended dsDNA product complex 分子名称: DNA(5'-D(*CP*GP*TP*AP*AP*TP*AP*CP*G)-3'), DNA-(apurinic or apyrimidinic site) endonuclease 著者 Liu, T.C, Hsiao, Y.Y. 登録日 2020-06-18 公開日 2021-01-13 最終更新日 2023-11-29 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 APE1 distinguishes DNA substrates in exonucleolytic cleavage by induced space-filling. Nat Commun, 12, 2021
6YI9	Crystal structure of the rat cytosolic PCK1, acetylated on Lys244 分子名称: 1,2-ETHANEDIOL, Phosphoenolpyruvate carboxykinase, cytosolic [GTP] 著者 Latorre-Muro, P, Baeza, J, Hurtado-Guerrero, R, Hicks, T, Delso, I, Hernandez-Ruiz, C, Velazquez-Campoy, A, Lawton, A.J, Angulo, J, Denu, J.M, Carrodeguas, J.A. 登録日 2020-04-01 公開日 2020-12-23 最終更新日 2024-01-24 実験手法 X-RAY DIFFRACTION (1.75 Å) 主引用文献 Self-acetylation at the active site of phosphoenolpyruvate carboxykinase (PCK1) controls enzyme activity. J.Biol.Chem., 296, 2021
6Z45	CDK9-Cyclin-T1 complex bound by compound 24 分子名称: (1~{S},3~{R})-3-acetamido-~{N}-[5-chloranyl-4-(5,5-dimethyl-4,6-dihydropyrrolo[1,2-b]pyrazol-3-yl)pyridin-2-yl]cyclohexane-1-carboxamide, 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL, Cyclin-T1, ... 著者 Ferguson, A, Collie, G.W. 登録日 2020-05-22 公開日 2020-12-23 最終更新日 2024-05-01 実験手法 X-RAY DIFFRACTION (3.37 Å) 主引用文献 Discovery of AZD4573, a Potent and Selective Inhibitor of CDK9 That Enables Short Duration of Target Engagement for the Treatment of Hematological Malignancies. J.Med.Chem., 63, 2020
6V90	Crystal structure of the p300 acetyltransferase domain with AcCoA competitive inhibitor 12 分子名称: (2R)-2-{[2-(4-cyanophenyl)ethyl]amino}-N-[5-(1-methyl-1H-pyrazol-4-yl)pyridin-2-yl]-2-phenylacetamide, CHLORIDE ION, Histone acetyltransferase p300, ... 著者 Gardberg, A.S. 登録日 2019-12-12 公開日 2020-04-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.04 Å) 主引用文献 Early Drug-Discovery Efforts towards the Identification of EP300/CBP Histone Acetyltransferase (HAT) Inhibitors. Chemmedchem, 15, 2020
6V8B	Crystal structure of the p300 acetyltransferase domain with AcCoA competitive inhibitor 1 分子名称: 4-(2-{[(1R)-2-(1H-indol-3-yl)-2-oxo-1-phenylethyl]amino}ethyl)benzene-1-sulfonamide, CHLORIDE ION, Histone acetyltransferase p300, ... 著者 Gardberg, A.S. 登録日 2019-12-10 公開日 2020-04-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (3.13 Å) 主引用文献 Early Drug-Discovery Efforts towards the Identification of EP300/CBP Histone Acetyltransferase (HAT) Inhibitors. Chemmedchem, 15, 2020
6V8K	Crystal structure of the p300 acetyltransferase domain with peptide-competitive inhibitor 2 分子名称: 1-(2-methyl-1H-indol-3-yl)-2-[(2R)-2-methylpiperidin-1-yl]ethan-1-one, COENZYME A, DIMETHYL SULFOXIDE, ... 著者 Gardberg, A.S. 登録日 2019-12-11 公開日 2020-04-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.84 Å) 主引用文献 Early Drug-Discovery Efforts towards the Identification of EP300/CBP Histone Acetyltransferase (HAT) Inhibitors. Chemmedchem, 15, 2020
6V8N	Crystal structure of the p300 acetyltransferase domain with AcCoA competitive inhibitor 17 分子名称: (2R)-2-{[(2S)-2-(4-cyanophenyl)propyl]amino}-N-[5-(1-methyl-1H-pyrazol-4-yl)pyridin-2-yl]-2-phenylacetamide, CHLORIDE ION, Histone acetyltransferase p300, ... 著者 Gardberg, A.S, Wilson, J.E. 登録日 2019-12-11 公開日 2020-04-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 Early Drug-Discovery Efforts towards the Identification of EP300/CBP Histone Acetyltransferase (HAT) Inhibitors. Chemmedchem, 15, 2020
6UV4	Crystal structure of the core domain of RNA helicase DDX17 with RNA pri-18a-oligo1 分子名称: 18a_oligo1, ADENOSINE-5'-DIPHOSPHATE, BERYLLIUM TRIFLUORIDE ION, ... 著者 Ngo, T.D, Partin, A.C, Nam, Y. 登録日 2019-11-01 公開日 2020-01-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.7 Å) 主引用文献 RNA Specificity and Autoregulation of DDX17, a Modulator of MicroRNA Biogenesis. Cell Rep, 29, 2019
6UV3	Crystal structure of the core domain of RNA helicase DDX17 with RNA pri-125a-oligo2 分子名称: 125a-oligo2, ADENOSINE-5'-DIPHOSPHATE, BERYLLIUM TRIFLUORIDE ION, ... 著者 Ngo, T.D, Partin, A.C, Nam, Y. 登録日 2019-11-01 公開日 2020-01-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.597 Å) 主引用文献 RNA Specificity and Autoregulation of DDX17, a Modulator of MicroRNA Biogenesis. Cell Rep, 29, 2019
6UV0	Crystal structure of apo core domain of RNA helicase DDX17 分子名称: MAGNESIUM ION, Probable ATP-dependent RNA helicase DDX17 著者 Ngo, T.D, Partin, A.C, Nam, Y. 登録日 2019-11-01 公開日 2020-01-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.601 Å) 主引用文献 RNA Specificity and Autoregulation of DDX17, a Modulator of MicroRNA Biogenesis. Cell Rep, 29, 2019
6UV1	Crystal structure of RNA helicase DDX17 in complex of rU10 RNA 分子名称: ADENOSINE-5'-DIPHOSPHATE, BERYLLIUM TRIFLUORIDE ION, MAGNESIUM ION, ... 著者 Ngo, T.D, Partin, A.C, Nam, Y. 登録日 2019-11-01 公開日 2020-01-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.307 Å) 主引用文献 RNA Specificity and Autoregulation of DDX17, a Modulator of MicroRNA Biogenesis. Cell Rep, 29, 2019
6UV2	Crystal structure of the core domain of RNA helicase DDX17 with RNA pri-125a-oligo1 分子名称: ADENOSINE-5'-DIPHOSPHATE, BERYLLIUM TRIFLUORIDE ION, MAGNESIUM ION, ... 著者 Ngo, T.D, Partin, A.C, Nam, Y. 登録日 2019-11-01 公開日 2020-01-01 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (1.894 Å) 主引用文献 RNA Specificity and Autoregulation of DDX17, a Modulator of MicroRNA Biogenesis. Cell Rep, 29, 2019
6PF1	Crystal structure of the p300 acetyltransferase domain with allosteric inhibitor CPI-090 and CoA 分子名称: 3-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-methyl-1H-indole, COENZYME A, Histone acetyltransferase p300 著者 Gardberg, A.S. 登録日 2019-06-21 公開日 2019-10-23 最終更新日 2024-03-13 実験手法 X-RAY DIFFRACTION (2.32 Å) 主引用文献 Make the right measurement: Discovery of an allosteric inhibition site for p300-HAT. Struct Dyn., 6, 2019
6PGU	Crystal structure of the p300 acetyltransferase domain with allosteric inhibitor CPI-076 and CoA 分子名称: COENZYME A, Histone acetyltransferase p300, N-(thiophen-2-yl)acetamide 著者 Gardberg, A.S, Poy, F, Setser, J. 登録日 2019-06-24 公開日 2019-10-23 最終更新日 2024-05-22 実験手法 X-RAY DIFFRACTION (1.72 Å) 主引用文献 Make the right measurement: Discovery of an allosteric inhibition site for p300-HAT. Struct Dyn., 6, 2019
6P5O	The structure of rat cytosolic PEPCK in complex with 3-(carboxymethylthiol)-picolinic acid 分子名称: 3-[(carboxymethyl)sulfanyl]pyridine-2-carboxylic acid, MANGANESE (II) ION, Phosphoenolpyruvate carboxykinase, ... 著者 Mcleod, M.J, Holyoak, T. 登録日 2019-05-30 公開日 2019-09-18 最終更新日 2023-10-11 実験手法 X-RAY DIFFRACTION (1.49 Å) 主引用文献 Characterization of 3-[(Carboxymethyl)thio]picolinic Acid: A Novel Inhibitor of Phosphoenolpyruvate Carboxykinase. Biochemistry, 58, 2019
6K4N	Cryo-EM structure of p300 分子名称: Histone acetyltransferase p300 著者 Ghosh, R, Roy, S, Sengupta, J. 登録日 2019-05-24 公開日 2019-06-19 最終更新日 2024-03-27 実験手法 ELECTRON MICROSCOPY (9.8 Å) 主引用文献 Tumor Suppressor p53-Mediated Structural Reorganization of the Transcriptional Coactivator p300. Biochemistry, 58, 2019
5XZC	Cryo-EM structure of p300-p53 protein complex 分子名称: Cellular tumor antigen p53, Histone acetyltransferase p300 著者 Ghosh, R, Roy, S, Sengupta, J. 登録日 2017-07-12 公開日 2019-01-23 最終更新日 2024-03-27 実験手法 ELECTRON MICROSCOPY (10.7 Å) 主引用文献 Tumor suppressor p53-mediated structural reorganization of the transcriptional coactivator p300. Biochemistry, 2019
6CYT	HIV-1 TAR loop in complex with Tat:AFF4:P-TEFb 分子名称: AF4/FMR2 family member 4, Cyclin-T1, Cyclin-dependent kinase 9, ... 著者 Schulze Gahmen, U, Hurley, J.H. 登録日 2018-04-06 公開日 2018-12-12 最終更新日 2023-10-04 実験手法 X-RAY DIFFRACTION (3.5 Å) 主引用文献 Structural mechanism for HIV-1 TAR loop recognition by Tat and the super elongation complex. Proc. Natl. Acad. Sci. U.S.A., 115, 2018
6MCF	Solution structure of 7SK stem-loop 1 with HIV-1 Tat RNA Binding Domain 分子名称: 7SK Stem-loop 1 RNA, Protein Tat 著者 Pham, V.V, D'Souza, V.M. 登録日 2018-08-31 公開日 2018-10-31 最終更新日 2024-05-01 実験手法 SOLUTION NMR 主引用文献 HIV-1 Tat interactions with cellular 7SK and viral TAR RNAs identifies dual structural mimicry. Nat Commun, 9, 2018
6MCE	Solution structure of HIV-1 TAR with Tat RNA Binding Domain 分子名称: Protein Tat, TAR RNA 著者 Pham, V.V, D'Souza, V.M. 登録日 2018-08-31 公開日 2018-10-31 最終更新日 2024-05-01 実験手法 SOLUTION NMR 主引用文献 HIV-1 Tat interactions with cellular 7SK and viral TAR RNAs identifies dual structural mimicry. Nat Commun, 9, 2018
6GYR	Transcription factor dimerization activates the p300 acetyltransferase 分子名称: Histone acetyltransferase p300, ZINC ION, [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3R,20R)-20-carbamoyl-3-hydroxy-2,2-dimethyl-4,8,14,22-tetraoxo-12-thia-5,9,15,21-tetraazatricos-1-yl dihydrogen diphosphate 著者 Panne, D, Ortega, E. 登録日 2018-07-01 公開日 2018-10-17 最終更新日 2024-01-17 実験手法 X-RAY DIFFRACTION (3.1 Å) 主引用文献 Transcription factor dimerization activates the p300 acetyltransferase. Nature, 562, 2018

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