5EQS

Crystal structure of a genotype 1a/3a chimeric HCV NS3/4A protease in complex with Asunaprevir

5EQS の概要

• エントリーDOI: 10.2210/pdb5eqs/pdb
• 関連するPDBエントリー: 5EQQ 5EQR
• 分子名称: NS3 protease, N-(tert-butoxycarbonyl)-3-methyl-L-valyl-(4R)-4-[(7-chloro-4-methoxyisoquinolin-1-yl)oxy]-N-{(1R,2S)-1-[(cyclopropylsulfonyl)carbamoyl]-2-ethenylcyclopropyl}-L-prolinamide, ZINC ION, ... (4 entities in total)
• 機能のキーワード: asunaprevir, drug resistance, hcv protease inhibitor, genotype 3, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Hepatitis C virus
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 21116.65

構造登録者

Soumana, D.,Yilmaz, N.K.,Ali, A.,Prachanronarong, K.L.,Schiffer, C.A. (登録日: 2015-11-13, 公開日: 2016-11-23, 最終更新日: 2023-09-27)

• 主引用文献: Soumana, D.I.,Kurt Yilmaz, N.,Ali, A.,Prachanronarong, K.L.,Schiffer, C.A.; Molecular and Dynamic Mechanism Underlying Drug Resistance in Genotype 3 Hepatitis C NS3/4A Protease.; J.Am.Chem.Soc., 138:11850-11859, 2016; PubMed: 27512818; DOI: 10.1021/jacs.6b06454

実験手法

X-RAY DIFFRACTION (1.839 Å)