5TYS
X-ray crystal structure of wild type HIV-1 protease in complex with GRL-142
Summary for 5TYS
Entry DOI | 10.2210/pdb5tys/pdb |
Related | 4HLA 5TYR |
Descriptor | 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) |
Functional Keywords | grl-142, hiv-1 protease, protease-inhibitor, darunavir, pyran, furan, nonpeptidic, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Human immunodeficiency virus 1 |
Total number of polymer chains | 2 |
Total formula weight | 22314.33 |
Authors | Yedidi, R.S.,Hayashi, H.,Aoki, M.,Das, D.,Ghosh, A.K.,Mitsuya, H. (deposition date: 2016-11-21, release date: 2017-10-18, Last modification date: 2023-10-04) |
Primary citation | 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 Cited by PubMed: 29039736DOI: 10.7554/eLife.28020 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.007 Å) |
Structure validation
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