6C8Y

D30N HIV-1 protease in complex with a phenylboronic acid (P2') analog of darunavir

6C8Y の概要

• エントリーDOI: 10.2210/pdb6c8y/pdb
• 分子名称: Protease, CHLORIDE ION, [4-[[(2~{R},3~{S})-3-[[(3~{a}~{S},4~{R},6~{a}~{R})-2,3,3~{a},4,5,6~{a}-hexahydrofuro[2,3-b]furan-4-yl]oxycarbonylamino]-2-oxidanyl-4-phenyl-butyl]-(2-methylpropyl)sulfamoyl]phenyl]-oxidanyl-oxidanylidene-boron, ... (5 entities in total)
• 機能のキーワード: hiv, protease, boronic acid, inhibitor, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Human immunodeficiency virus 1
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 22253.29

構造登録者

Windsor, I.W.,Raines, R.T.,Forest, K.T. (登録日: 2018-01-25, 公開日: 2018-12-05, 最終更新日: 2023-10-04)

• 主引用文献: Windsor, I.W.,Palte, M.J.,Lukesh 3rd., J.C.,Gold, B.,Forest, K.T.,Raines, R.T.; Sub-picomolar Inhibition of HIV-1 Protease with a Boronic Acid.; J. Am. Chem. Soc., 140:14015-14018, 2018; PubMed: 30346745; DOI: 10.1021/jacs.8b07366

実験手法

X-RAY DIFFRACTION (1.942 Å)