PDB: 36840 件ウェブページステータス検索Chemie searchBIRD

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3O50	Crystal structure of benzamide 9 bound to AuroraA 分子名称: N-{3-methyl-4-[(3-pyrimidin-4-ylpyridin-2-yl)oxy]phenyl}-3-(trifluoromethyl)benzamide, cDNA FLJ58295, highly similar to Serine/threonine-protein kinase 6 著者 Huang, X. 登録日 2010-07-27 公開日 2010-08-18 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Discovery of a potent, selective, and orally bioavailable pyridinyl-pyrimidine phthalazine aurora kinase inhibitor. J.Med.Chem., 53, 2010
3NNX	Crystal structure of phosphorylated P38 alpha in complex with DP802 分子名称: 2-[3-(3-tert-butyl-5-{[(2,3-dichlorophenyl)carbamoyl]imino}-2,5-dihydro-1H-pyrazol-1-yl)phenyl]acetamide, Mitogen-activated protein kinase 14 著者 Abendroth, J. 登録日 2010-06-24 公開日 2010-09-15 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (2.28 Å) 主引用文献 Switch control pocket inhibitors of p38-MAP kinase. Durable type II inhibitors that do not require binding into the canonical ATP hinge region Bioorg.Med.Chem.Lett., 20, 2010
1BQY	Plasminogen activator (TSV-PA) from snake venom 分子名称: L-alpha-glutamyl-N-{(1S)-4-{[amino(iminio)methyl]amino}-1-[(1S)-2-chloro-1-hydroxyethyl]butyl}glycinamide, PLASMINOGEN ACTIVATOR 著者 Parry, M.A.A, Bode, W. 登録日 1998-08-20 公開日 1999-08-20 最終更新日 2023-08-09 実験手法 X-RAY DIFFRACTION (2.5 Å) 主引用文献 The crystal structure of the novel snake venom plasminogen activator TSV-PA: a prototype structure for snake venom serine proteinases. Structure, 6, 1998
1C1P	RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES 分子名称: (5-AMIDINO-2-BENZIMIDAZOLYL)(2-BENZIMIDAZOLYL)METHANE, CALCIUM ION, DIMETHYL SULFOXIDE, ... 著者 Katz, B.A, Luong, C. 登録日 1999-07-21 公開日 2000-07-26 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.37 Å) 主引用文献 Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
1C2M	RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES 分子名称: CALCIUM ION, MAGNESIUM ION, SULFATE ION, ... 著者 Katz, B.A, Luong, C. 登録日 1999-07-21 公開日 2000-07-26 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
1BTY	Crystal structure of beta-trypsin in complex with benzamidine 分子名称: BENZAMIDINE, BETA-TRYPSIN, CALCIUM ION 著者 Stroud, R.M, Katz, B.A, Finer-Moore, J. 登録日 1995-05-17 公開日 1995-10-15 最終更新日 2011-07-13 実験手法 X-RAY DIFFRACTION (1.5 Å) 主引用文献 Episelection: novel Ki approximately nanomolar inhibitors of serine proteases selected by binding or chemistry on an enzyme surface. Biochemistry, 34, 1995
1BRU	STRUCTURE OF PORCINE PANCREATIC ELASTASE COMPLEXED WITH THE ELASTASE INHIBITOR GR143783 分子名称: 2-(2-HYDROXY-CYCLOPENTYL)-PENT-4-ENAL, ELASTASE 著者 Jhoti, H, Singh, O.M.P, Wonacott, A. 登録日 1998-08-24 公開日 1999-08-25 最終更新日 2018-04-18 実験手法 X-RAY DIFFRACTION (2.3 Å) 主引用文献 To be Published
3O71	Crystal structure of ERK2/DCC peptide complex 分子名称: Mitogen-activated protein kinase 1, Peptide of Deleted in Colorectal Cancer, THIOCYANATE ION 著者 Ma, W.F, Shang, Y, Wei, Z.Y, Wen, W.Y, Wang, W.N, Zhang, M.J. 登録日 2010-07-30 公開日 2011-06-15 最終更新日 2024-03-20 実験手法 X-RAY DIFFRACTION (1.95 Å) 主引用文献 Phosphorylation of DCC by ERK2 is facilitated by direct docking of the receptor P1 domain to the kinase Structure, 18, 2010
3OD6	Crystal structure of p38alpha Y323T active mutant 分子名称: Mitogen-activated protein kinase 14, octyl beta-D-glucopyranoside 著者 Livnah, O, Tzarum, N. 登録日 2010-08-11 公開日 2011-01-12 最終更新日 2024-02-21 実験手法 X-RAY DIFFRACTION (2.682 Å) 主引用文献 Active mutants of the TCR-mediated p38alpha alternative activation site show changes in the phosphorylation lip and DEF site formation. J.Mol.Biol., 405, 2011
1C2G	RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES 分子名称: BIS(5-AMIDINO-2-BENZIMIDAZOLYL)METHANE KETONE HYDRATE, CALCIUM ION, DIMETHYL SULFOXIDE, ... 著者 Katz, B.A, Luong, C. 登録日 1999-07-21 公開日 2000-07-26 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.65 Å) 主引用文献 Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
1BTZ	Episelection: novel KI ~nanomolar inhibitors of serine proteases selected by binding or chemistry on an enzyme surface 分子名称: BETA-TRYPSIN, CALCIUM ION, N-(tert-butoxycarbonyl)-L-alanyl-N-{(1R)-5-ammonio-1-[hydroxy(methoxy)boranyl]pentyl}-L-valinamide 著者 Stroud, R.M, Katz, B.A, Finer-Moore, J. 登録日 1995-05-17 公開日 1995-10-15 最終更新日 2012-12-12 実験手法 X-RAY DIFFRACTION (2 Å) 主引用文献 Episelection: novel Ki approximately nanomolar inhibitors of serine proteases selected by binding or chemistry on an enzyme surface. Biochemistry, 34, 1995
3NNV	Crystal structure of P38 alpha in complex with DP437 分子名称: 1-{3-tert-butyl-1-[4-(hydroxymethyl)phenyl]-1H-pyrazol-5-yl}-3-naphthalen-1-ylurea, Mitogen-activated protein kinase 14 著者 Abendroth, J. 登録日 2010-06-24 公開日 2010-09-15 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Switch control pocket inhibitors of p38-MAP kinase. Durable type II inhibitors that do not require binding into the canonical ATP hinge region Bioorg.Med.Chem.Lett., 20, 2010
3NRM	Imidazo[1,2-a]pyrazine-based Aurora Kinase Inhibitors 分子名称: N-(3-methylisothiazol-5-yl)-3-(1H-pyrazol-4-yl)imidazo[1,2-a]pyrazin-8-amine, Serine/threonine-protein kinase 6 著者 Hruza, A. 登録日 2010-06-30 公開日 2010-08-18 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (3.05 Å) 主引用文献 Discovery of imidazo[1,2-a]pyrazine-based Aurora kinase inhibitors. Bioorg.Med.Chem.Lett., 20, 2010
1C1N	RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES 分子名称: BENZAMIDINE, CALCIUM ION, SULFATE ION, ... 著者 Katz, B.A, Luong, C. 登録日 1999-07-21 公開日 2000-07-26 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
3NUY	phosphoinositide-dependent kinase-1 (PDK1) with fragment17 分子名称: GLYCEROL, PkB-like, SULFATE ION, ... 著者 Campobasso, N, Ward, P. 登録日 2010-07-07 公開日 2011-05-25 最終更新日 2018-10-10 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Aminoindazole PDK1 Inhibitors: A Case Study in Fragment-Based Drug Discovery. ACS Med Chem Lett, 1, 2010
1C2H	RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES 分子名称: BIS(5-AMIDINO-2-BENZIMIDAZOLYL)METHANE KETONE, CALCIUM ION, MAGNESIUM ION, ... 著者 Katz, B.A, Luong, C. 登録日 1999-07-21 公開日 2000-07-26 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
1C2J	RECRUITING ZINC TO MEDIATE POTENT, SPECIFIC INHIBITION OF SERINE PROTEASES 分子名称: BIS(5-AMIDINO-2-BENZIMIDAZOLYL)METHANE KETONE, CALCIUM ION, MAGNESIUM ION, ... 著者 Katz, B.A, Luong, C. 登録日 1999-07-21 公開日 2000-07-26 最終更新日 2023-12-27 実験手法 X-RAY DIFFRACTION (1.4 Å) 主引用文献 Design of potent selective zinc-mediated serine protease inhibitors. Nature, 391, 1998
3NR9	Structure of human CDC2-like kinase 2 (CLK2) 分子名称: (5Z)-5-(quinolin-6-ylmethylidene)-2-[(thiophen-2-ylmethyl)amino]-1,3-thiazol-4(5H)-one, Dual specificity protein kinase CLK2 著者 Chaikuad, A, Savitsky, P, Krojer, T, Muniz, J.R.C, Filippakopoulos, P, Rellos, P, Keates, T, Fedorov, O, Pike, A.C.W, Eswaran, J, Berridge, G, Phillips, C, Zhang, Y, von Delft, F, Weigelt, J, Arrowsmith, C.H, Edwards, A.M, Bountra, C, Knapp, S, Structural Genomics Consortium (SGC) 登録日 2010-06-30 公開日 2010-08-25 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.89 Å) 主引用文献 Structure of human CDC2-like kinase 2 (CLK2) To be Published
3NUU	phosphoinositide-dependent kinase-1 (PDK1) with fragment11 分子名称: 3,4-dihydroisoquinolin-1(2H)-one, GLYCEROL, PkB-like, ... 著者 Campobasso, N, Ward, P. 登録日 2010-07-07 公開日 2011-05-25 最終更新日 2018-10-10 実験手法 X-RAY DIFFRACTION (1.9803 Å) 主引用文献 Aminoindazole PDK1 Inhibitors: A Case Study in Fragment-Based Drug Discovery. ACS Med Chem Lett, 1, 2010
3O8U	Conformational plasticity of p38 MAP kinase DFG motif mutants in response to inhibitor binding 分子名称: 1-(5-TERT-BUTYL-2-METHYL-2H-PYRAZOL-3-YL)-3-(4-CHLORO-PHENYL)-UREA, Mitogen-activated protein kinase 14, octyl beta-D-glucopyranoside 著者 Namboodiri, H.V, Karpusas, M, Bukhtiyarova, M, Springman, E.B. 登録日 2010-08-03 公開日 2010-09-01 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.1 Å) 主引用文献 Conformational plasticity of p38 MAP kinase DFG motif mutants in response to inhibitor binding To be Published
3OHT	Crystal Structure of Salmo Salar p38alpha 分子名称: N-(2-CHLORO-6-METHYLPHENYL)-2-({6-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]-2-METHYLPYRIMIDIN-4-YL}AMINO)-1,3-THIAZOLE-5-CARBOXAMIDE, SULFATE ION, p38a 著者 Rothweiler, U, Johnson, K, Engh, R.A. 登録日 2010-08-18 公開日 2011-06-29 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (2.7 Å) 主引用文献 p38alpha MAP kinase dimers with swapped activation segments and a novel catalytic loop conformation J.Mol.Biol., 411, 2011
3ORZ	PDK1 mutant bound to allosteric disulfide fragment activator 2A2 分子名称: 3-(1H-INDOL-3-YL)-4-{1-[2-(1-METHYLPYRROLIDIN-2-YL)ETHYL]-1H-INDOL-3-YL}-1H-PYRROLE-2,5-DIONE, 3-phosphoinositide-dependent protein kinase 1, 4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutane-1-thiol 著者 Sadowsky, J.D, Wells, J.A. 登録日 2010-09-08 公開日 2011-03-23 最終更新日 2023-09-06 実験手法 X-RAY DIFFRACTION (1.9995 Å) 主引用文献 Turning a protein kinase on or off from a single allosteric site via disulfide trapping. Proc.Natl.Acad.Sci.USA, 108, 2011
5QBB	Crystal structure of Endothiapepsin-FRG140 complex 分子名称: 3-[(5-tert-butyl-1,2-oxazol-3-yl)methyl]oxetan-3-amine, DIMETHYL SULFOXIDE, Endothiapepsin, ... 著者 Huschmann, F. 登録日 2017-08-04 公開日 2020-04-22 最終更新日 2021-11-17 実験手法 X-RAY DIFFRACTION (1.759 Å) 主引用文献 Crystal structure of Endothiapepsin To be published
5QBJ	Crystal structure of Endothiapepsin-FRG283 complex 分子名称: 4-(2-{[methyl(prop-2-yn-1-yl)amino]methyl}-1,3-thiazol-4-yl)piperidin-4-ol, ACETATE ION, Endothiapepsin, ... 著者 Huschmann, F. 登録日 2017-08-04 公開日 2020-04-22 最終更新日 2021-11-17 実験手法 X-RAY DIFFRACTION (1.699 Å) 主引用文献 Crystal structure of Endothiapepsin To be published
5QBR	Crystal structure of Endothiapepsin 分子名称: (3R,5R)-5-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-ol, ACETATE ION, DIMETHYL SULFOXIDE, ... 著者 Huschmann, F. 登録日 2017-08-04 公開日 2020-04-22 最終更新日 2021-11-17 実験手法 X-RAY DIFFRACTION (1.418 Å) 主引用文献 Crystal structure of Endothiapepsin To be published

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