3KDC

Crystal Structure of HIV-1 Protease (Q7K, L33I, L63I) in Complex with KNI-10074

3KDC の概要

• エントリーDOI: 10.2210/pdb3kdc/pdb
• 関連するPDBエントリー: 2PK5 2PK6 3KDB 3KDD
• 関連するBIRD辞書のPRD_ID: PRD_000582
• 分子名称: Protease, (4R)-3-[(2S,3S)-3-{[(2,6-dichlorophenoxy)acetyl]amino}-2-hydroxy-4-phenylbutanoyl]-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]-5,5-dimethyl-1,3-thiazolidine-4-carboxamide, GLYCEROL, ... (5 entities in total)
• 機能のキーワード: viral protein, hydrolase, protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Human immunodeficiency virus type 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: 22516.14

構造登録者

Chufan, E.E.,Kawasaki, Y.,Freire, E.,Amzel, L.M. (登録日: 2009-10-22, 公開日: 2010-03-16, 最終更新日: 2023-09-06)

• 主引用文献: Kawasaki, Y.,Chufan, E.E.,Lafont, V.,Hidaka, K.,Kiso, Y.,Mario Amzel, L.,Freire, E.; How much binding affinity can be gained by filling a cavity?; Chem.Biol.Drug Des., 75:143-151, 2010; PubMed: 20028396; DOI: 10.1111/j.1747-0285.2009.00921.x

実験手法

X-RAY DIFFRACTION (2.2 Å)