2FDD

Crystal structure of HIV protease D545701 bound with GW0385

Summary for 2FDD

• Entry DOI: 10.2210/pdb2fdd/pdb
• Related: 2FDE
• Descriptor: Gag-Pol polyprotein, (3R,3AS,6AR)-HEXAHYDROFURO[2,3-B]FURAN-3-YL [(1S,2R)-3-[(1,3-BENZODIOXOL-5-YLSULFONYL)(ISOBUTYL)AMINO]-2-HYDROXY-1-{4-[(2-METHYL-1,3-THIAZOL-4-YL)METHOXY]BENZYL}PROPYL]CARBAMATE (3 entities in total)
• Functional Keywords: hiv protease, inhibitor, hydrolase
• Biological source: Human immunodeficiency virus 1
• Total number of polymer chains: 2
• Total formula weight: 22533.37

Authors

Xu, R.X. (deposition date: 2005-12-13, release date: 2006-02-21, Last modification date: 2024-02-14)

• Primary citation: Miller, J.F.,Andrews, C.W.,Brieger, M.,Furfine, E.S.,Hale, M.R.,Hanlon, M.H.,Hazen, R.J.,Kaldor, I.,McLean, E.W.,Reynolds, D.,Sammond, D.M.,Spaltenstein, A.,Tung, R.,Turner, E.M.,Xu, R.X.,Sherrill, R.G.; Ultra-potent P1 modified arylsulfonamide HIV protease inhibitors: The discovery of GW0385.; Bioorg.Med.Chem.Lett., 16:1788-1794, 2006; PubMed: 16458505; DOI: 10.1016/j.bmcl.2006.01.035

Experimental method

X-RAY DIFFRACTION (1.58 Å)