5K14

HIV-1 Reverse Transcriptase in complex with a 2,6-difluorophenyl DAPY analog

Summary for 5K14

• Entry DOI: 10.2210/pdb5k14/pdb
• Descriptor: HIV-1 reverse transcriptase(isolate HXB2), HIV-1 reverse transcriptase (isolate LW123), 4-{[4-(2,6-difluoro-4-methoxybenzene-1-carbonyl)pyrimidin-2-yl]amino}benzonitrile, ... (4 entities in total)
• Functional Keywords: hiv-1, reverse transcriptase, nnrti, inhibitor complex, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• Biological source: Human immunodeficiency virus type 1 group M subtype B (isolate HXB2) (HIV-1); More
• 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 : P04585 P0C6F2
• Total number of polymer chains: 2
• Total formula weight: 116328.32

Authors

Lansdon, E.B. (deposition date: 2016-05-17, release date: 2016-06-29, Last modification date: 2024-03-06)

• Primary citation: Simon, P.,Baszczynski, O.,Saman, D.,Stepan, G.,Hu, E.,Lansdon, E.B.,Jansa, P.,Janeba, Z.; Novel (2,6-difluorophenyl)(2-(phenylamino)pyrimidin-4-yl)methanones with restricted conformation as potent non-nucleoside reverse transcriptase inhibitors against HIV-1.; Eur.J.Med.Chem., 122:185-195, 2016; PubMed: 27371922; DOI: 10.1016/j.ejmech.2016.06.026

Experimental method

X-RAY DIFFRACTION (2.402 Å)