3HPT

Crystal structure of human FxA in complex with (S)-2-cyano-1-(2-methylbenzofuran-5-yl)-3-(2-oxo-1-(2-oxo-2-(pyrrolidin-1-yl)ethyl)azepan-3-yl)guanidine

3HPT の概要

• エントリーDOI: 10.2210/pdb3hpt/pdb
• 分子名称: Coagulation factor X, GLYCEROL, 1-cyano-2-(2-methyl-1-benzofuran-5-yl)-3-[(3S)-2-oxo-1-(2-oxo-2-pyrrolidin-1-ylethyl)azepan-3-yl]guanidine, ... (10 entities in total)
• 機能のキーワード: serine protease, hydrolase, epidermal growth factor like domain, blood coagulation factor, cleavage on pair of basic residues, egf-like domain, gamma-carboxyglutamic acid, glycoprotein, hydroxylation, zymogen, blood clotting, blood coagulation, disulfide bond, protease, secreted
• 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: 4
• 化学式量合計: 76648.65

構造登録者

Klei, H.E.,Ghosh, K.,Rushith, A.,Kish, K. (登録日: 2009-06-04, 公開日: 2009-11-17, 最終更新日: 2017-11-01)

• 主引用文献: Shi, Y.,Zhang, J.,Shi, M.,O'Connor, S.P.,Bisaha, S.N.,Li, C.,Sitkoff, D.,Pudzianowski, A.T.,Chong, S.,Klei, H.E.,Kish, K.,Yanchunas, J.,Liu, E.C.,Hartl, K.S.,Seiler, S.M.,Steinbacher, T.E.,Schumacher, W.A.,Atwal, K.S.,Stein, P.D.; Cyanoguanidine-based lactam derivatives as a novel class of orally bioavailable factor Xa inhibitors.; Bioorg.Med.Chem.Lett., 19:4034-4041, 2009; PubMed: 19541481; DOI: 10.1016/j.bmcl.2009.06.014

実験手法

X-RAY DIFFRACTION (2.19 Å)