4DJR

Crystal Structure of wild-type HIV-1 Protease in Complex with MKP97

Summary for 4DJR

Entry DOI	10.2210/pdb4djr/pdb
Related	4DJO 4DJP 4DJQ
Descriptor	Pol polyprotein, [(2S)-5-oxopyrrolidin-2-yl]methyl [(2S,3R)-4-{(1,3-benzothiazol-6-ylsulfonyl)[(2S)-2-methylbutyl]amino}-3-hydroxy-1-phenylbutan-2-yl]carbamate, PHOSPHATE ION, ... (4 entities in total)
Functional Keywords	hiv-1 protease, drug resistance, drug design, protease inhibitors, aids, aspartyl protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological source	Human immunodeficiency virus 1
Total number of polymer chains	2
Total formula weight	22505.23
Authors	Schiffer, C.A.,Nalam, M.N.L. (deposition date: 2012-02-02, release date: 2012-08-01, Last modification date: 2024-02-28)
Primary citation	Parai, M.K.,Huggins, D.J.,Cao, H.,Nalam, M.N.,Ali, A.,Schiffer, C.A.,Tidor, B.,Rana, T.M. Design, synthesis, and biological and structural evaluations of novel HIV-1 protease inhibitors to combat drug resistance. J.Med.Chem., 55:6328-6341, 2012 Cited by PubMed: 22708897 DOI: 10.1021/jm300238h PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.55 Å)

Structure validation