3VFB
Crystal Structure of HIV-1 Protease Mutant N88D with novel P1'-Ligands GRL-02031
Summary for 3VFB
Entry DOI | 10.2210/pdb3vfb/pdb |
Related | 3H5B 3VF5 3VF7 3VFA |
Descriptor | protease, (3aS,5R,6aR)-hexahydro-2H-cyclopenta[b]furan-5-yl [(1S,2R)-1-benzyl-2-hydroxy-3-([(4-methoxyphenyl)sulfonyl]{[(2R)-5-oxopyrrolidin-2-yl]methyl}amino)propyl]carbamate, CHLORIDE ION, ... (6 entities in total) |
Functional Keywords | protease inhibitor, p1'-ligand, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
Biological source | Human immunodeficiency virus type 1 (BRU ISOLATE) (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 : P03367 |
Total number of polymer chains | 2 |
Total formula weight | 22455.21 |
Authors | Yu, X.X.,Wang, Y.F.,Chang, Y.C.E.,Weber, I.T. (deposition date: 2012-01-09, release date: 2012-11-21, Last modification date: 2023-09-13) |
Primary citation | Chang, Y.C.,Yu, X.,Zhang, Y.,Tie, Y.,Wang, Y.F.,Yashchuk, S.,Ghosh, A.K.,Harrison, R.W.,Weber, I.T. Potent antiviral HIV-1 protease inhibitor GRL-02031 adapts to the structures of drug resistant mutants with its P1'-pyrrolidinone ring. J.Med.Chem., 55:3387-3397, 2012 Cited by PubMed: 22401672DOI: 10.1021/jm300072d PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.55 Å) |
Structure validation
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