2F9B

Discovery of Novel Heterocyclic Factor VIIa Inhibitors

2F9B の概要

• エントリーDOI: 10.2210/pdb2f9b/pdb
• 関連するPDBエントリー: 1O5D
• 分子名称: Coagulation factor VII, Tissue factor, {5-(5-AMINO-1H-PYRROLO[3,2-B]PYRIDIN-2-YL)-6-HYDROXY-3'-NITRO-BIPHENYL-3-YL]-ACETIC ACID, ... (5 entities in total)
• 機能のキーワード: serine protease, short hydrogen bond, active site-directed inhibitor, hydrolase-blood clotting complex, hydrolase/blood clotting
• 由来する生物種: Homo sapiens (human); 詳細
• 細胞内の位置: Secreted: P08709 P08709; Isoform 1: Membrane ; Single-pass type I membrane protein . Isoform 2: Secreted : P13726
• タンパク質・核酸の鎖数: 3
• 化学式量合計: 70294.04

構造登録者

Rai, R.,Kolesnikov, A.,Sprengeler, P.A.,Torkelson, S.,Ton, T.,Katz, B.A.,Yu, C.,Hendrix, J.,Shrader, W.D.,Stephens, R.,Cabuslay, R.,Sanford, E.,Young, W.B. (登録日: 2005-12-05, 公開日: 2006-02-28, 最終更新日: 2024-10-16)

主引用文献

Rai, R.,Kolesnikov, A.,Sprengeler, P.A.,Torkelson, S.,Ton, T.,Katz, B.A.,Yu, C.,Hendrix, J.,Shrader, W.D.,Stephens, R.,Cabuslay, R.,Sanford, E.,Young, W.B.
Discovery of novel heterocyclic factor VIIa inhibitors.
Bioorg.Med.Chem.Lett., 16:2270-2273, 2006

PubMed Abstract: Structure-activity relationships and binding mode of novel heterocyclic factor VIIa inhibitors will be described. In these inhibitors, a highly basic 5-amidinoindole moiety has been successfully replaced with a less basic 5-aminopyrrolo[3,2-b]pyridine scaffold.

PubMed: 16460932
DOI: 10.1016/j.bmcl.2006.01.017

実験手法

X-RAY DIFFRACTION (2.54 Å)