6B4N
a hydroxymethyl functionality at the 4-position of the 2-phenyloxazole moiety of HIV-1 protease inhibitors involving the P2' ligands
Summary for 6B4N
Entry DOI | 10.2210/pdb6b4n/pdb |
Related | 2IEN |
Descriptor | Protease, methyl 2-{4-[{(2R,3S)-3-[({[(3R,3aS,6aR)-hexahydrofuro[2,3-b]furan-3-yl]oxy}carbonyl)amino]-2-hydroxy-4-phenylbutyl}(2-methylpropyl)sulfamoyl]phenyl}-1,3-oxazole-4-carboxylate, SODIUM ION, ... (5 entities in total) |
Functional Keywords | hiv protease, the 2-phenyloxazole moiety inhibitor, p2' ligands, drug resistance, hydrolase, antiviral protein, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Human immunodeficiency virus 1 |
Total number of polymer chains | 2 |
Total formula weight | 22326.88 |
Authors | Wang, Y.-F.,Agniswamy, J.,Weber, I.T. (deposition date: 2017-09-27, release date: 2017-11-22, Last modification date: 2023-10-04) |
Primary citation | Ghosh, A.K.,Fyvie, W.S.,Brindisi, M.,Steffey, M.,Agniswamy, J.,Wang, Y.F.,Aoki, M.,Amano, M.,Weber, I.T.,Mitsuya, H. Design, Synthesis, Biological Evaluation, and X-ray Studies of HIV-1 Protease Inhibitors with Modified P2' Ligands of Darunavir. ChemMedChem, 12:1942-1952, 2017 Cited by PubMed: 29110408DOI: 10.1002/cmdc.201700614 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.3 Å) |
Structure validation
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