3NWX

X-ray structure of ester chemical analogue [O-Ile50,O-Ile50']HIV-1 protease complexed with KVS-1 inhibitor

Summary for 3NWX

Entry DOI	10.2210/pdb3nwx/pdb
Related	3FSM 3HAU 3HDK 3HLO 3IAW 3NWQ 3NXE 3NXN 3NYG
Related PRD ID	PRD_001037
Descriptor	protease, SULFATE ION, N~2~-[(2R,5S)-5-({(2S,3S)-2-[(N-acetyl-L-threonyl)amino]-3-methylpent-4-enoyl}amino)-2-butyl-4,4-dihydroxynonanoyl]-L-glutaminyl-L-argininamide, ... (4 entities in total)
Functional Keywords	beta-barrel, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Total number of polymer chains	2
Total formula weight	22804.52
Authors	Torbeev, V.Y.,Kent, S.B.H. (deposition date: 2010-07-12, release date: 2011-11-02, Last modification date: 2019-07-31)
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: 22158985 DOI: 10.1073/pnas.1111202108 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.9 Å)

Structure validation