3CKT

HIV-1 protease in complex with a dimethylallyl decorated pyrrolidine based inhibitor (orthorombic space group)

3CKT の概要

• エントリーDOI: 10.2210/pdb3ckt/pdb
• 関連するPDBエントリー: 2ZGA
• 分子名称: Protease, CHLORIDE ION, (3S,4S),-3,4-Bis-[(4-carbamoyl-benzensulfonyl)-(3-methyl-but-2-enyl)-amino]-pyrrolidine, ... (4 entities in total)
• 機能のキーワード: hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Human immunodeficiency virus 1 (HIV-1)
• 細胞内の位置: Matrix protein p17: Virion (Potential). Capsid protein p24: Virion (Potential). Nucleocapsid protein p7: Virion (Potential). Reverse transcriptase/ribonuclease H: Virion (Potential). Integrase: Virion (Potential): P03367
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 22282.17

構造登録者

Boettcher, J.,Blum, A.,Heine, A.,Diederich, W.E.,Klebe, G. (登録日: 2008-03-17, 公開日: 2009-03-24, 最終更新日: 2023-11-01)

• 主引用文献: Blum, A.,Bottcher, J.,Dorr, S.,Heine, A.,Klebe, G.,Diederich, W.E.; Two Solutions for the Same Problem: Multiple Binding Modes of Pyrrolidine-Based HIV-1 Protease Inhibitors; J.Mol.Biol., 410:745-755, 2011; PubMed: 21762812; DOI: 10.1016/j.jmb.2011.04.052

実験手法

X-RAY DIFFRACTION (1.65 Å)