3DRS

HIV reverse transcriptase K103N mutant in complex with inhibitor R8D

Summary for 3DRS

• Entry DOI: 10.2210/pdb3drs/pdb
• Related: 3DRP 3DRR
• Descriptor: Reverse transcriptase/ribonuclease H, p66 RT, 3-chloro-5-[2-chloro-5-(1H-pyrazolo[3,4-b]pyridin-3-ylmethoxy)phenoxy]benzonitrile (3 entities in total)
• Functional Keywords: hiv-1 reverse transcriptase, non-nucleoside inhibition, nucleotidyltrasferase, hydrolase, transferase
• Biological source: Human immunodeficiency virus type 1 (HIV-1); More
• 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): P04585 P04585
• Total number of polymer chains: 2
• Total formula weight: 117007.82

Authors

Yan, Y.,Prasad, S. (deposition date: 2008-07-11, release date: 2008-10-14, Last modification date: 2023-08-30)

• Primary citation: Tucker, T.J.,Sisko, J.T.,Tynebor, R.M.,Williams, T.M.,Felock, P.J.,Flynn, J.A.,Lai, M.T.,Liang, Y.,McGaughey, G.,Liu, M.,Miller, M.,Moyer, G.,Munshi, V.,Perlow-Poehnelt, R.,Prasad, S.,Reid, J.C.,Sanchez, R.,Torrent, M.,Vacca, J.P.,Wan, B.L.,Yan, Y.; Discovery of 3-{5-[(6-Amino-1H-pyrazolo[3,4-b]pyridine-3-yl)methoxy]-2-chlorophenoxy}-5-chlorobenzonitrile (MK-4965): A Potent, Orally Bioavailable HIV-1 Non-Nucleoside Reverse Transcriptase Inhibitor with Improved Potency against Key Mutant Viruses.; J.Med.Chem., 51:6503-6511, 2008; PubMed: 18826204; DOI: 10.1021/jm800856c

Experimental method

X-RAY DIFFRACTION (3.15 Å)