5TYS

X-ray crystal structure of wild type HIV-1 protease in complex with GRL-142

5TYS の概要

• エントリーDOI: 10.2210/pdb5tys/pdb
• 関連するPDBエントリー: 4HLA 5TYR
• 分子名称: Protease, (3S,3aR,5R,7aS,8S)-hexahydro-4H-3,5-methanofuro[2,3-b]pyran-8-yl [(2S,3R)-4-[{[2-(cyclopropylamino)-1,3-benzothiazol-6-yl]sulfonyl}(2-methylpropyl)amino]-1-(3,5-difluorophenyl)-3-hydroxybutan-2-yl]carbamate (3 entities in total)
• 機能のキーワード: grl-142, hiv-1 protease, protease-inhibitor, darunavir, pyran, furan, nonpeptidic, 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: 22314.33

構造登録者

Yedidi, R.S.,Hayashi, H.,Aoki, M.,Das, D.,Ghosh, A.K.,Mitsuya, H. (登録日: 2016-11-21, 公開日: 2017-10-18, 最終更新日: 2023-10-04)

• 主引用文献: Aoki, M.,Hayashi, H.,Rao, K.V.,Das, D.,Higashi-Kuwata, N.,Bulut, H.,Aoki-Ogata, H.,Takamatsu, Y.,Yedidi, R.S.,Davis, D.A.,Hattori, S.I.,Nishida, N.,Hasegawa, K.,Takamune, N.,Nyalapatla, P.R.,Osswald, H.L.,Jono, H.,Saito, H.,Yarchoan, R.,Misumi, S.,Ghosh, A.K.,Mitsuya, H.; A novel central nervous system-penetrating protease inhibitor overcomes human immunodeficiency virus 1 resistance with unprecedented aM to pM potency.; Elife, 6:-, 2017; PubMed: 29039736; DOI: 10.7554/eLife.28020

実験手法

X-RAY DIFFRACTION (2.007 Å)