3QAA

HIV-1 wild type protease with a substituted bis-Tetrahydrofuran inhibitor, GRL-044-10A

Summary for 3QAA

• Entry DOI: 10.2210/pdb3qaa/pdb
• Related: 2IEN 3OK9
• Descriptor: HIV-1 Protease, (3R,3aS,4R,6aR)-4-methoxyhexahydrofuro[2,3-b]furan-3-yl [(2S,3R)-3-hydroxy-4-{[(4-methoxyphenyl)sulfonyl](2-methylpropyl)amino}-1-phenylbutan-2-yl]carbamate, SODIUM ION, ... (6 entities in total)
• Functional Keywords: aspartic acid protease, hiv-1 protease inhibitor grl-044-10a, substituted bis-tetrahydrofuran inhibitor, wild-type hiv-1 protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• Biological source: Human immunodeficiency virus 1 (HIV-1)
• Cellular location: Gag-Pol polyprotein: Host cell membrane; Lipid-anchor. Matrix protein p17: Virion membrane; Lipid- anchor . Capsid protein p24: Virion . Nucleocapsid protein p7: Virion . Reverse transcriptase/ribonuclease H: Virion . Integrase: Virion : P03366
• Total number of polymer chains: 2
• Total formula weight: 22444.23

Authors

Wang, Y.-F.,Agniswamy, J.,Weber, I.T. (deposition date: 2011-01-10, release date: 2011-12-21, Last modification date: 2023-09-13)

• Primary citation: Ghosh, A.K.,Martyr, C.D.,Steffey, M.,Wang, Y.F.,Agniswamy, J.,Amano, M.,Weber, I.T.,Mitsuya, H.; Design of substituted bis-Tetrahydrofuran (bis-THF)-derived Potent HIV-1 Protease Inhibitors, Protein-ligand X-ray Structure, and Convenient Syntheses of bis-THF and Substituted bis-THF Ligands.; ACS Med Chem Lett, 2:298-302, 2011; PubMed: 22509432

Experimental method

X-RAY DIFFRACTION (1.4 Å)