7T9H
HIV Integrase in complex with Compound-15
Summary for 7T9H
Entry DOI | 10.2210/pdb7t9h/pdb |
Descriptor | Integrase, MAGNESIUM ION, (2S)-tert-butoxy[2-methyl-4-(4-methylphenyl)quinolin-3-yl]acetic acid, ... (4 entities in total) |
Functional Keywords | dna integration, aids, rnaseh, ledgf, endonuclease, hiv-1 integrase, dna binding protein, viral protein |
Biological source | Human immunodeficiency virus 1 |
Total number of polymer chains | 2 |
Total formula weight | 37018.71 |
Authors | Khan, J.A.,Lewis, H.,Kish, K. (deposition date: 2021-12-19, release date: 2022-04-06, Last modification date: 2023-10-18) |
Primary citation | Naidu, B.N.,Patel, M.,McAuliffe, B.,Ding, B.,Cianci, C.,Simmermacher, J.,Jenkins, S.,Parker, D.D.,Sivaprakasam, P.,Khan, J.A.,Kish, K.,Lewis, H.,Hanumegowda, U.,Krystal, M.,Meanwell, N.A.,Kadow, J.F. Design, Synthesis, and Preclinical Profiling of GSK3739936 (BMS-986180), an Allosteric Inhibitor of HIV-1 Integrase with Broad-Spectrum Activity toward 124/125 Polymorphs. J.Med.Chem., 65:4949-4971, 2022 Cited by PubMed: 35235334DOI: 10.1021/acs.jmedchem.1c02169 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.53 Å) |
Structure validation
Download full validation report