6M08

Crystal structure of Lp-PLA2 in complex with a novel covalent inhibitor.

6M08 の概要

• エントリーDOI: 10.2210/pdb6m08/pdb
• 分子名称: Platelet-activating factor acetylhydrolase, (2S)-2-[(Z)-3-[2-(diethylamino)ethyl-[[4-[4-(trifluoromethyl)phenyl]phenyl]methyl]amino]-1-oxidanyl-3-oxidanylidene-prop-1-enyl]pyrrolidine-1-carboxylic acid (3 entities in total)
• 機能のキーワード: lp-pla2, covalent inhibitor, complex structure, serine phospholipase., hydrolase
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 85067.71

構造登録者

Hu, H.C.,Xu, Y.C. (登録日: 2020-02-20, 公開日: 2020-12-30, 最終更新日: 2023-11-29)

• 主引用文献: Huang, F.,Hu, H.,Wang, K.,Peng, C.,Xu, W.,Zhang, Y.,Gao, J.,Liu, Y.,Zhou, H.,Huang, R.,Li, M.,Shen, J.,Xu, Y.; Identification of Highly Selective Lipoprotein-Associated Phospholipase A2 (Lp-PLA2) Inhibitors by a Covalent Fragment-Based Approach.; J.Med.Chem., 63:7052-7065, 2020; PubMed: 32459096; DOI: 10.1021/acs.jmedchem.0c00372

実験手法

X-RAY DIFFRACTION (2.19 Å)