8A1Q
HIV-1 Integrase Catalytic Core Domain and C-Terminal Domain in Complex with Allosteric Integrase Inhibitor STP0404 (Pirmitegravir)
Summary for 8A1Q
Entry DOI | 10.2210/pdb8a1q/pdb |
Descriptor | Integrase, 1,2-ETHANEDIOL, (2S)-tert-butoxy{4-(4-chlorophenyl)-2,3,6-trimethyl-1-[(1-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl}acetic acid, ... (5 entities in total) |
Functional Keywords | integrase, hiv, allini, stp0404, allosteric inhibitor, inhibitor, retrovirus, inlai, ncini, mini, ledgin, viral protein, pirmitegravir |
Biological source | Human immunodeficiency virus 1 More |
Total number of polymer chains | 4 |
Total formula weight | 105587.80 |
Authors | Singer, M.R.,Pye, V.E.,Cook, N.J.,Cherepanov, P. (deposition date: 2022-06-01, release date: 2023-02-01, Last modification date: 2024-02-07) |
Primary citation | Singer, M.R.,Dinh, T.,Levintov, L.,Annamalai, A.S.,Rey, J.S.,Briganti, L.,Cook, N.J.,Pye, V.E.,Taylor, I.A.,Kim, K.,Engelman, A.N.,Kim, B.,Perilla, J.R.,Kvaratskhelia, M.,Cherepanov, P. The Drug-Induced Interface That Drives HIV-1 Integrase Hypermultimerization and Loss of Function. Mbio, 14:e0356022-e0356022, 2023 Cited by PubMed: 36744954DOI: 10.1128/mbio.03560-22 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.06 Å) |
Structure validation
Download full validation report