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3HAU

Crystal structure of chemically synthesized HIV-1 protease with reduced isostere MVT-101 inhibitor

Summary for 3HAU
Entry DOI10.2210/pdb3hau/pdb
Related3FSM 3GI0
Related PRD IDPRD_000398
DescriptorHIV-1 protease, 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 Keywordsbeta barrel, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Total number of polymer chains2
Total formula weight22302.25
Authors
Torbeev, V.Y.,Kent, S.B.H. (deposition date: 2009-05-02, release date: 2011-04-27, Last modification date: 2012-12-12)
Primary citationTorbeev, 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: 22158985
DOI: 10.1073/pnas.1111202108
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.3 Å)
Structure validation

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