PDB: 12060 件ウェブページステータス検索Chemie searchBIRD

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7LRK	Crystal structure of BPTF bromodomain in complex with inhibitor Pdy-3-093 分子名称: 1,2-ETHANEDIOL, 4-chloranyl-2-methyl-5-[[(3~{S})-pyrrolidin-3-yl]amino]pyridazin-3-one, Nucleosome-remodeling factor subunit BPTF 著者 Chan, A, Schonbrunn, E. 登録日 2021-02-16 公開日 2022-08-10 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.44 Å) 主引用文献 New Design Rules for Developing Potent Cell-Active Inhibitors of the Nucleosome Remodeling Factor (NURF) via BPTF Bromodomain Inhibition. J.Med.Chem., 64, 2021
7LPK	Crystal structure of BPTF bromodomain in complex with inhibitor HZ-03-112 分子名称: 1,2-ETHANEDIOL, 4-chloranyl-2-methyl-5-[[(3~{R})-pyrrolidin-3-yl]amino]pyridazin-3-one, Nucleosome-remodeling factor subunit BPTF 著者 Chan, A, Schonbrunn, E. 登録日 2021-02-12 公開日 2022-08-10 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.39 Å) 主引用文献 New Design Rules for Developing Potent Cell-Active Inhibitors of the Nucleosome Remodeling Factor (NURF) via BPTF Bromodomain Inhibition. J.Med.Chem., 64, 2021
7LRO	Crystal structure of BPTF bromodomain in complex with inhibitor HZ-01-105 分子名称: 1,2-ETHANEDIOL, 5-(azetidin-3-ylamino)-4-chloranyl-2-methyl-pyridazin-3-one, DIMETHYL SULFOXIDE, ... 著者 Chan, A, Schonbrunn, E. 登録日 2021-02-17 公開日 2022-08-10 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (1.45 Å) 主引用文献 New Design Rules for Developing Potent Cell-Active Inhibitors of the Nucleosome Remodeling Factor (NURF) via BPTF Bromodomain Inhibition. J.Med.Chem., 64, 2021
7K6S	Crystal structure of the bromodomain (BD) of human Bromodomain and PHD finger-containing Transcription Factor (BPTF) bound to Compound 4 (SKT1174) 分子名称: (7-amino-3,4-dihydroquinolin-1(2H)-yl)(cyclopropyl)methanone, 1,2-ETHANEDIOL, CHLORIDE ION, ... 著者 Chan, A, Schonbrunn, E. 登録日 2020-09-21 公開日 2020-12-09 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.23 Å) 主引用文献 New inhibitors for the BPTF bromodomain enabled by structural biology and biophysical assay development. Org.Biomol.Chem., 18, 2020
7KDW	Crystal structure of the bromodomain (BD) of human Bromodomain and PHD finger-containing Transcription Factor (BPTF) bound to Compound 6 (HZ01052) 分子名称: 1,2-ETHANEDIOL, Nucleosome-remodeling factor subunit BPTF, cyclopropyl[7-({2-[(prop-2-yn-1-yl)amino]pyrimidin-4-yl}amino)-3,4-dihydroquinolin-1(2H)-yl]methanone 著者 Chan, A, Schonbrunn, E. 登録日 2020-10-09 公開日 2020-12-09 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.71 Å) 主引用文献 New inhibitors for the BPTF bromodomain enabled by structural biology and biophysical assay development Organic and Biomolecular Chemistry, 18(27), 2020
7K6R	Crystal structure of the bromodomain (BD) of human Bromodomain and PHD finger-containing Transcription Factor (BPTF) bound to GSK4027 分子名称: 1,2-ETHANEDIOL, 4-bromo-2-methyl-5-[[(3~{R},5~{R})-1-methyl-5-phenyl-piperidin-3-yl]amino]pyridazin-3-one, Nucleosome-remodeling factor subunit BPTF 著者 Chan, A, Schonbrunn, E. 登録日 2020-09-21 公開日 2020-12-09 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (1.6 Å) 主引用文献 New inhibitors for the BPTF bromodomain enabled by structural biology and biophysical assay development. Org.Biomol.Chem., 18, 2020
7KA0	Crystal structure of the complex of M. tuberculosis PheRS with cognate precursor tRNA and phenylalanine 分子名称: ACETATE ION, GLYCEROL, MAGNESIUM ION, ... 著者 Chang, C, Michalska, K, Jedrzejczak, R, Wower, J, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2020-09-29 公開日 2021-05-12 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Mycobacterium tuberculosis Phe-tRNA synthetase: structural insights into tRNA recognition and aminoacylation. Nucleic Acids Res., 49, 2021
7K9M	Crystal structure of the complex of M. tuberculosis PheRS with cognate precursor tRNA and 5'-O-(N-phenylalanyl)sulfamoyl-adenosine 分子名称: 5'-O-(L-phenylalanylsulfamoyl)adenosine, GLYCEROL, HEXAETHYLENE GLYCOL, ... 著者 Michalska, K, Chang, C, Jedrzejczak, R, Wower, J, Baragana, B, Forte, B, Gilbert, I.H, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2020-09-29 公開日 2021-05-12 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Mycobacterium tuberculosis Phe-tRNA synthetase: structural insights into tRNA recognition and aminoacylation. Nucleic Acids Res., 49, 2021
7KAB	M. tuberculosis PheRS complex with cognate precursor tRNA and phenylalanine 分子名称: GLYCEROL, MAGNESIUM ION, PHENYLALANINE, ... 著者 Chang, C, Michalska, K, Jedrzejczak, R, Wower, J, Joachimiak, A, Center for Structural Genomics of Infectious Diseases (CSGID) 登録日 2020-09-30 公開日 2021-05-12 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 Mycobacterium tuberculosis Phe-tRNA synthetase: structural insights into tRNA recognition and aminoacylation. Nucleic Acids Res., 49, 2021
7M7V	Crystal Structure of Mtb Pks13 Thioesterase domain in complex with Compound 6 分子名称: 5-hydroxy-2-(4-hydroxyphenyl)-N-methyl-4-[(2-oxa-6-azaspiro[3.4]octan-6-yl)methyl]-1-benzofuran-3-carboxamide, Polyketide synthase Pks13 著者 Aggarwal, A, Sacchettini, J.C. 登録日 2021-03-29 公開日 2022-02-16 最終更新日 2023-10-18 実験手法 X-RAY DIFFRACTION (2.29 Å) 主引用文献 Optimization of TAM16, a Benzofuran That Inhibits the Thioesterase Activity of Pks13; Evaluation toward a Preclinical Candidate for a Novel Antituberculosis Clinical Target. J.Med.Chem., 65, 2022
1N8Y	Crystal structure of the extracellular region of rat HER2 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, 2-acetamido-2-deoxy-beta-D-glucopyranose-(1-4)-2-acetamido-2-deoxy-beta-D-glucopyranose, protooncoprotein 著者 Cho, H.-S, Mason, K, Ramyar, K.X, Stanley, A.M, Gabelli, S.B, Denney Jr, D.W, Leahy, D.J. 登録日 2002-11-21 公開日 2003-02-18 最終更新日 2023-08-16 実験手法 X-RAY DIFFRACTION (2.4 Å) 主引用文献 Structure of the Extracellular Region of HER2 Alone and in complex with the Herceptin Fab Nature, 421, 2003
1NU6	Crystal structure of human Dipeptidyl Peptidase IV (DPP-IV) 分子名称: 2-acetamido-2-deoxy-beta-D-glucopyranose, Dipeptidyl peptidase IV, MERCURY (II) ION 著者 Hennig, M, Stihle, M, Thoma, R, Ruf, A. 登録日 2003-01-31 公開日 2003-08-26 最終更新日 2020-07-29 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Structural Basis of Proline-Specific Exopeptidase Activity as Observed in Human Dipeptidyl Peptidase-IV. Structure, 11, 2003
1OT7	Structural Basis for 3-deoxy-CDCA Binding and Activation of FXR 分子名称: 6-ETHYL-CHENODEOXYCHOLIC ACID, Bile Acid Receptor, ISO-URSODEOXYCHOLIC ACID, ... 著者 Mi, L.Z, Devarakonda, S, Harp, J.M, Han, Q, Pellicciari, R, Willson, T.M, Khorasanizadeh, S, Rastinejad, F. 登録日 2003-03-21 公開日 2004-03-23 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2.9 Å) 主引用文献 Structural Basis for Bile Acid Binding and Activation of the Nuclear Receptor FXR Mol.Cell, 11, 2003
1PAE	nucleoside diphosphate kinase 分子名称: Nucleoside diphosphate kinase, cytosolic, SELENIUM ATOM 著者 Strub, M.-P, Hoh, F, Sanchez, J.-F, Strub, J.M, Bock, A, Aumelas, A, Dumas, C. 登録日 2003-05-14 公開日 2003-11-11 最終更新日 2021-10-27 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Selenomethionine and Selenocysteine Double Labeling Strategy for Crystallographic Phasing Structure, 11, 2003
1OYE	Structural Basis of Multiple Binding Capacity of the AcrB multidrug Efflux Pump 分子名称: 1-CYCLOPROPYL-6-FLUORO-4-OXO-7-PIPERAZIN-1-YL-1,4-DIHYDROQUINOLINE-3-CARBOXYLIC ACID, Acriflavine resistance protein B 著者 Yu, E.W, McDermott, G, Zgurskaya, H.I, Nikaido, H, Koshland Jr, D.E. 登録日 2003-04-03 公開日 2003-05-13 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (3.48 Å) 主引用文献 Structural basis of multiple drug-binding capacity of the AcrB multidrug efflux pump. Science, 300, 2003
1OZ1	P38 MITOGEN-ACTIVATED KINASE IN COMPLEX WITH 4-AZAINDOLE INHIBITOR 分子名称: 3-(4-FLUOROPHENYL)-2-PYRIDIN-4-YL-1H-PYRROLO[3,2-B]PYRIDIN-1-OL, Mitogen-activated protein kinase 14 著者 Lovejoy, B, Villasenor, A, Browner, M, Dunten, P. 登録日 2003-04-07 公開日 2003-09-23 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Design and synthesis of 4-azaindoles as inhibitors of p38 MAP kinase. J.Med.Chem., 46, 2003
1OY9	Structural Basis of Multiple Drug Binding Capacity of the AcrB Multidrug Efflux Pump 分子名称: Acriflavine resistance protein B, ETHIDIUM 著者 Yu, E.W, McDermott, G, Zgurskaya, H.I, Nikaido, H, Koshland Jr, D.E. 登録日 2003-04-03 公開日 2003-05-13 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (3.8 Å) 主引用文献 Structural basis of multiple drug-binding capacity of the AcrB multidrug efflux pump. Science, 300, 2003
1P4Z	Effect of Sequence on the Conformational Geometry of DNA Holliday Junctions 分子名称: 5'-D(*CP*CP*AP*GP*TP*AP*CP*TP*GP*G)-3', SODIUM ION 著者 Hays, F.A, Vargason, J.M, Ho, P.S. 登録日 2003-04-24 公開日 2003-09-02 最終更新日 2024-04-03 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Effect of Sequence on the Conformation of DNA Holliday Junctions Biochemistry, 42, 2003
1OXG	Crystal structure of a complex formed between organic solvent treated bovine alpha-chymotrypsin and its autocatalytically produced highly potent 14-residue peptide at 2.2 resolution 分子名称: Chymotrypsinogen A, SULFATE ION 著者 Singh, N, Jabeen, T, Sharma, S, Roy, I, Gupta, M.N, Bilgrami, S, Singh, T.P. 登録日 2003-04-02 公開日 2004-05-18 最終更新日 2023-10-25 実験手法 X-RAY DIFFRACTION (2.2 Å) 主引用文献 Detection of native peptides as potent inhibitors of enzymes. Crystal structure of the complex formed between treated bovine alpha-chymotrypsin and an autocatalytically produced fragment, IIe-Val-Asn-Gly-Glu-Glu-Ala-Val-Pro-Gly-Ser-Trp-Pro-Trp, at 2.2 angstroms resolution. Febs J., 272, 2005
1OYD	Structural Basis of Multiple Binding Capacity of the AcrB multidrug Efflux Pump 分子名称: Acriflavine resistance protein B, DEQUALINIUM 著者 Yu, E.W, MeDermott, G, Zgurskaya, H.I, Nikaido, H, Koshland Jr, D.E. 登録日 2003-04-03 公開日 2003-05-13 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (3.8 Å) 主引用文献 Structural basis of multiple drug-binding capacity of the AcrB multidrug efflux pump. Science, 300, 2003
1P14	Crystal structure of a catalytic-loop mutant of the insulin receptor tyrosine kinase 分子名称: insulin receptor 著者 Li, S, Covino, N.D, Stein, E.G, Till, J.H, Hubbard, S.R. 登録日 2003-04-11 公開日 2003-07-22 最終更新日 2023-08-16 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Structural and biochemical evidence for an autoinhibitory role for tyrosine 984 in the juxtamembrane region of the insulin receptor J.Biol.Chem., 278, 2003
1OY6	Structural Basis of the Multiple Binding Capacity of the AcrB Multidrug Efflux Pump 分子名称: Acriflavine resistance protein B 著者 Yu, E.W, McDermott, G, Zgurskaya, H.I, Nikaido, H, Koshland Jr, D.E. 登録日 2003-04-03 公開日 2003-05-13 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (3.68 Å) 主引用文献 Structural basis of multiple drug-binding capacity of the AcrB multidrug efflux pump. Science, 300, 2003
1OY8	Structural Basis of Multiple Drug Binding Capacity of the AcrB Multidrug Efflux Pump 分子名称: Acriflavine resistance protein B, RHODAMINE 6G 著者 Yu, E.W, McDermott, G, Zgurskaya, H.I, Nikaido, H, Koshland Jr, D.E. 登録日 2003-04-03 公開日 2003-05-13 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (3.63 Å) 主引用文献 Structural basis of multiple drug-binding capacity of the AcrB multidrug efflux pump. Science, 300, 2003
1PA3	Crystal Structure of Glutathione-S-transferase from Plasmodium falciparum 分子名称: Glutathione s-transferase, putative 著者 Perbandt, M, Betzel, C, Liebau, E. 登録日 2003-05-13 公開日 2003-11-25 最終更新日 2024-02-14 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 Native and inhibited structure of a Mu class-related glutathione S-transferase from Plasmodium falciparum J.Biol.Chem., 279, 2004
1P54	Effect of Sequence on the Conformational Geometry of DNA Holliday Junctions 分子名称: 5'-D(*CP*CP*AP*GP*TP*AP*CP*(BRU)P*GP*G)-3', CALCIUM ION, SODIUM ION 著者 Hays, F.A, Vargason, J.M, Ho, P.S. 登録日 2003-04-25 公開日 2003-09-02 最終更新日 2023-08-16 実験手法 X-RAY DIFFRACTION (1.9 Å) 主引用文献 Effect of Sequence on the Conformation of DNA Holliday Junctions Biochemistry, 42, 2003

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