6PTP
Joint X-ray/neutron structure of HIV-1 protease triple mutant (V32I,I47V,V82I) with tetrahedral intermediate mimic KVS-1
Summary for 6PTP
Entry DOI | 10.2210/pdb6ptp/pdb |
Descriptor | HIV-1 Protease, N~2~-[(2R,5S)-5-({(2S,3S)-2-[(N-acetyl-L-threonyl)amino]-3-methylpent-4-enoyl}amino)-2-butyl-4,4-dihydroxynonanoyl]-L-glutaminyl-L-argininamide (3 entities in total) |
Functional Keywords | hiv-1 protease, aspartic protease, homodimer, hydrolase |
Biological source | Human immunodeficiency virus 1 |
Total number of polymer chains | 2 |
Total formula weight | 22310.39 |
Authors | Kovalevsky, A.,Das, A. (deposition date: 2019-07-16, release date: 2020-06-10, Last modification date: 2023-10-25) |
Primary citation | Kumar, M.,Mandal, K.,Blakeley, M.P.,Wymore, T.,Kent, S.B.H.,Louis, J.M.,Das, A.,Kovalevsky, A. Visualizing Tetrahedral Oxyanion Bound in HIV-1 Protease Using Neutrons: Implications for the Catalytic Mechanism and Drug Design. Acs Omega, 5:11605-11617, 2020 Cited by PubMed: 32478251DOI: 10.1021/acsomega.0c00835 PDB entries with the same primary citation |
Experimental method | NEUTRON DIFFRACTION (2.2 Å) X-RAY DIFFRACTION (1.85 Å) |
Structure validation
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