4BTI

factor Xa in complex with the dual thrombin-FXa inhibitor 58.

4BTI の概要

• エントリーDOI: 10.2210/pdb4bti/pdb
• 関連するPDBエントリー: 4BTT 4BTU
• 分子名称: COAGULATION FACTOR X HEAVY CHAIN, COAGULATION FACTOR X LIGHT CHAIN, CALCIUM ION, ... (5 entities in total)
• 機能のキーワード: hydrolase, sar107375, factor xa inhibitor, thrombin inhibitor, chlorothiophene p1 fragment, s3 subsite, microsomes stability, oral antithrombotic, dual inhibitor, iv antithrombotic
• 由来する生物種: HOMO SAPIENS (HUMAN); 詳細
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 79545.06

構造登録者

Meneyrol, J.,Follmann, M.,Lassalle, G.,Wehner, V.,Barre, G.,Rousseaux, T.,Altenburger, J.M.,Petit, F.,Bocskei, Z.,Stehlin-Gaon, C.,Schreuder, H.,Alet, N.,Herault, J.-P.,Millet, L.,Dol, F.,Hasbrand, C.,Schaeffer, P.,Sadoun, F.,Klieber, S.,Briot, C.,Bono, F.,Herbert, J.-M. (登録日: 2013-06-18, 公開日: 2013-12-25, 最終更新日: 2019-05-08)

• 主引用文献: Meneyrol, J.,Follmann, M.,Lassalle, G.,Wehner, V.,Barre, G.,Rousseaux, T.,Altenburger, J.,Petit, F.,Bocskei, Z.,Schreuder, H.,Alet, N.,Herault, J.,Millet, L.,Dol, F.,Florian, P.,Schaeffer, P.,Sadoun, F.,Klieber, S.,Briot, C.,Bono, F.,Herbert, J.; 5-Chlorothiophene-2-Carboxylic Acid [(S)-2-[2-Methyl-3-(2-Oxopyrrolidin-1-Yl)Benzenesulfonylamino]-3-(4-Methylpiperazin-1-Yl)-3-Oxopropyl]Amide (Sar107375), a Selective and Potent Orally Active Dual Thrombin and Factor Xa Inhibitor.; J.Med.Chem., 56:9441-, 2013; PubMed: 24175584; DOI: 10.1021/JM4005835

実験手法

X-RAY DIFFRACTION (2.3 Å)