6C7J

Crystal structure of human phosphodiesterase 2A with 1-(5-tert-butoxy-2-chloro-phenyl)-N-isobutyl-4-methyl-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide

6C7J の概要

• エントリーDOI: 10.2210/pdb6c7j/pdb
• 分子名称: cGMP-dependent 3',5'-cyclic phosphodiesterase, 1-(5-tert-butoxy-2-chlorophenyl)-4-methyl-N-(2-methylpropyl)[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide, ZINC ION, ... (5 entities in total)
• 機能のキーワード: phosphodiesterase, hydrolase
• 由来する生物種: Homo sapiens (Human)
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 161862.05

構造登録者

Xu, R.,Aertgeerts, K. (登録日: 2018-01-22, 公開日: 2018-08-15, 最終更新日: 2024-03-13)

• 主引用文献: Gomez, L.,Xu, R.,Sinko, W.,Selfridge, B.,Vernier, W.,Ly, K.,Truong, R.,Metz, M.,Marrone, T.,Sebring, K.,Yan, Y.,Appleton, B.,Aertgeerts, K.,Massari, M.E.,Breitenbucher, J.G.; Mathematical and Structural Characterization of Strong Nonadditive Structure-Activity Relationship Caused by Protein Conformational Changes.; J. Med. Chem., 61:7754-7766, 2018; PubMed: 30070482; DOI: 10.1021/acs.jmedchem.8b00713

実験手法

X-RAY DIFFRACTION (1.85 Å)