タイトル | Crystallographic analysis of potent and selective factor Xa inhibitors complexed to bovine trypsin. |
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ジャーナル・号・ページ | Acta Crystallogr. ,Sect. D, Vol. 55, Page 1395-1404, Year 1999 |
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掲載日 | 1999年4月9日 (構造データの登録日) |
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著者 | Whitlow, M. / Arnaiz, D.O. / Buckman, B.O. / Davey, D.D. / Griedel, B. / Guilford, W.J. / Koovakkat, S.K. / Liang, A. / Mohan, R. / Phillips, G.B. ...Whitlow, M. / Arnaiz, D.O. / Buckman, B.O. / Davey, D.D. / Griedel, B. / Guilford, W.J. / Koovakkat, S.K. / Liang, A. / Mohan, R. / Phillips, G.B. / Seto, M. / Shaw, K.J. / Xu, W. / Zhao, Z. / Light, D.R. / Morrissey, M.M. |
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リンク | Acta Crystallogr. ,Sect. D / PubMed:10417407 |
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手法 | X線回折 |
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解像度 | 1.8 Å |
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構造データ | PDB-1qa0: BOVINE TRYPSIN 2-AMINOBENZIMIDAZOLE COMPLEX 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-1qb1: Bovine Trypsin with 1-[2-[5-[amino(imino)methyl]-2-hydroxyphenoxy]-6-[3-(4,5-dihydro-1-methyl-1H-imidazol-2-yl)phenoxy]pyridin-4-yl]piperidine-3-carboxylic Acid (ZK-806974) 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-1qb6: BOVINE TRYPSIN 3,3'-[3,5-DIFLUORO-4-METHYL-2, 6-PYRIDINEDIYLBIS(OXY)]BIS(BENZENECARBOXIMIDAMIDE) (ZK-805623) COMPLEX 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-1qb9: BOVINE TRYPSIN 7-[[2-[[1-(1-IMINOETHYL)PIPERIDIN-4-YL]OXY]-9H-CARBOZOL-9-YL] METHYL]NAPHTHALENE-2-CARBOXIMIDAMIDE (ZK-806450) COMPLEX 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-1qbn: Bovine Trypsin 2-[amino(imino)methyl]-2-hydroxyphenoxy]-6-[3-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]pyridine-4-carboxylic Acid (ZK-806688) Complex 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å PDB-1qbo: BOVINE TRYPSIN 7-[[6-[[1-(1-IMINOETHYL)PIPERIDIN-4-YL]OXY]-2-METHYL-BENZIMIDAZOL-1-YL]METHYL]NAPHTHALENE-2-CARBOXIMIDAMID ZK-806711 INHIBITOR COMPLEX 手法: X-RAY DIFFRACTION / 解像度: 1.8 Å |
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化合物 | ChemComp-974: 1-[2-[5-[AMINO(IMINO)METHYL]-2-HYDROXYPHENOXY]-6-[3-(4,5-DIHYDRO-1-METHYL-1H-IMIDAZOL-2-YL)PHENOXY] PYRIDIN-4-YL]PIPERIDINE-3-CARBOXYLIC ACID
ChemComp-623: 3,3'-[3,5-DIFLUORO-4-METHYL-2,6-PYRIDYLENEBIS(OXY)]-BIS(BENZENECARBOXIMIDAMIDE)
ChemComp-806: 7-[[2-[[1-(1-IMINOETHYL)PIPERIDIN-4-YL]OXY]-9H-CARBOZOL-9-YL]METHYL]NAPHTHALENE-2-CARBOXIMIDAMID
ChemComp-688: 2-[AMINO(IMINO)METHYL]-2-HYDROXYPHENOXY]-6-[3-(4,5-DIHYDRO-1H-IMIDAZOL-2-YL)PHENOXY]PYRIDINE-4-CARBOXYLIC ACID
ChemComp-711: 7-[[6-[[1-(1-IMINOETHYL)PIPERIDIN-4-YL]OXY]-2-METHYL-BENZIMIDAZOL-1-YL]METHYL]NAPHTHALENE-2-CARBOXIMIDAMID
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由来 | |
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キーワード | HYDROLASE (加水分解酵素) / PROTEIN-INHIBITOR COMPLEX / S1 POCKET / SERINE PROTEASE (セリンプロテアーゼ) / SERINE PROTEINASE (セリンプロテアーゼ) / FACTOR XA (第X因子) / INHIBITOR COMPLEX (酵素阻害剤) |
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