3CS7

FACTOR XA IN COMPLEX WITH THE INHIBITOR 1-(4-methoxyphenyl)-6-(4-(1-(pyrrolidin-1-ylmethyl)cyclopropyl)phenyl)-3-(trifluoromethyl)-5,6-dihydro-1H-pyrazolo[3,4-c]pyridin-7(4H)-one

3CS7 の概要

• エントリーDOI: 10.2210/pdb3cs7/pdb
• 分子名称: Coagulation factor X, CALCIUM ION, 1-(4-methoxyphenyl)-6-(4-(1-(pyrrolidin-1-ylmethyl)cyclopropyl)phenyl)-3-(trifluoromethyl)-5,6-dihydro-1H-pyrazolo[3,4-c]pyridin-7(4H)-one, ... (5 entities in total)
• 機能のキーワード: glycoprotein, hydrolase, serine protease, plasma, blood coagulation factor, protein inhibitor complex, calcium-binding, cleavage on pair of basic residues, egf-like domain, gamma-carboxyglutamic acid, hydroxylation, polymorphism, zymogen, blood coagulation, calcium, protease
• 由来する生物種: Homo sapiens (Human); 詳細
• 細胞内の位置: Secreted: P00742 P00742
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 32586.97

構造登録者

Alexander, R.S. (登録日: 2008-04-09, 公開日: 2008-07-08, 最終更新日: 2011-07-13)

• 主引用文献: Qiao, J.X.,Cheney, D.L.,Alexander, R.S.,Smallwood, A.M.,King, S.R.,He, K.,Rendina, A.R.,Luettgen, J.M.,Knabb, R.M.,Wexler, R.R.,Lam, P.Y.; Achieving structural diversity using the perpendicular conformation of alpha-substituted phenylcyclopropanes to mimic the bioactive conformation of ortho-substituted biphenyl P4 moieties: discovery of novel, highly potent inhibitors of Factor Xa.; Bioorg.Med.Chem.Lett., 18:4118-4123, 2008; PubMed: 18550370; DOI: 10.1016/j.bmcl.2008.05.095

実験手法

X-RAY DIFFRACTION (2.2 Å)