2PWR
HIV-1 protease in complex with a carbamoyl decorated pyrrolidine-based inhibitor
Summary for 2PWR
Entry DOI | 10.2210/pdb2pwr/pdb |
Related | 1XL2 2PQZ 2PWC |
Descriptor | Gag-Pol polyprotein (Pr160Gag-Pol), CHLORIDE ION, 4,4'-{(3S,4S)-PYRROLIDINE-3,4-DIYLBIS[(BENZYLIMINO)SULFONYL]}DIBENZAMIDE, ... (5 entities in total) |
Functional Keywords | protein-ligand complex, hydrolase |
Biological source | Human immunodeficiency virus 1 |
Cellular location | Matrix protein p17: Virion (Potential). Capsid protein p24: Virion (Potential). Nucleocapsid protein p7: Virion (Potential). Reverse transcriptase/ribonuclease H: Virion (Potential). Integrase: Virion (Potential): P03367 |
Total number of polymer chains | 2 |
Total formula weight | 22453.73 |
Authors | Boettcher, B.,Blum, A.,Heine, A.,Diederich, W.E.,Klebe, G. (deposition date: 2007-05-12, release date: 2008-04-15, Last modification date: 2024-03-13) |
Primary citation | Blum, A.,Bottcher, J.,Heine, A.,Klebe, G.,Diederich, W.E. Structure-Guided Design of C2-Symmetric HIV-1 Protease Inhibitors Based on a Pyrrolidine Scaffold. J.Med.Chem., 51:2078-2087, 2008 Cited by PubMed: 18348517DOI: 10.1021/jm701142s PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.5 Å) |
Structure validation
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