3NXE
X-ray structure of ester chemical analogue 'covalent dimer' [Ile50,O-Ile50']HIV-1 protease complexed with MVT-101 inhibitor
Summary for 3NXE
Entry DOI | 10.2210/pdb3nxe/pdb |
Related | 3FSM 3HAU 3HDK 3HLO 3NWQ 3NWX 3NXN 3NYG |
Related PRD ID | PRD_000398 |
Descriptor | protease covalent dimer, N-{(2S)-2-[(N-acetyl-L-threonyl-L-isoleucyl)amino]hexyl}-L-norleucyl-L-glutaminyl-N~5~-[amino(iminio)methyl]-L-ornithinamide, SULFATE ION, ... (4 entities in total) |
Functional Keywords | beta-barrel, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Total number of polymer chains | 1 |
Total formula weight | 23047.87 |
Authors | Torbeev, V.Y.,Kent, S.B.H. (deposition date: 2010-07-13, release date: 2011-11-02, Last modification date: 2012-12-12) |
Primary citation | Torbeev, V.Y.,Raghuraman, H.,Hamelberg, D.,Tonelli, M.,Westler, W.M.,Perozo, E.,Kent, S.B. Protein conformational dynamics in the mechanism of HIV-1 protease catalysis. Proc.Natl.Acad.Sci.USA, 108:20982-20987, 2011 Cited by PubMed: 22158985DOI: 10.1073/pnas.1111202108 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.61 Å) |
Structure validation
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