5VQT

Crystal Structure of HIV-1 Reverse Transcriptase in Complex with 2-chloro-N-(6-cyano-3-(2-(2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy)phenoxy)-4-methylnaphthalen-1-yl)-N-methylacetamide (JLJ686), a Non-nucleoside Inhibitor

Summary for 5VQT

• Entry DOI: 10.2210/pdb5vqt/pdb
• Related: 5TER 5VQQ 5VQR 5VQS 5VQU 5VQV 5VQW 5VQX 5VQY 5VQZ
• Descriptor: Reverse transcriptase/ribonuclease H, p51 RT, 2-chloro-N-(6-cyano-3-{2-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenoxy}-4-methylnaphthalen-1-yl)-N-methylacetamide, ... (5 entities in total)
• Functional Keywords: polymerase, reverse transcriptase, hiv, non-nucleoside inhibitor, transferase-hydrolase-inhibitor complex, transferase/hydrolase/inhibitor
• Biological source: Human immunodeficiency virus type 1 group M subtype B (isolate BH10) (HIV-1); More
• Total number of polymer chains: 2
• Total formula weight: 114643.74

Authors

Chan, A.H.,Czyzyk, D.J.,Anderson, K.S. (deposition date: 2017-05-09, release date: 2017-08-23, Last modification date: 2023-10-04)

• Primary citation: Chan, A.H.,Lee, W.G.,Spasov, K.A.,Cisneros, J.A.,Kudalkar, S.N.,Petrova, Z.O.,Buckingham, A.B.,Anderson, K.S.,Jorgensen, W.L.; Covalent inhibitors for eradication of drug-resistant HIV-1 reverse transcriptase: From design to protein crystallography.; Proc. Natl. Acad. Sci. U.S.A., 114:9725-9730, 2017; PubMed: 28827354; DOI: 10.1073/pnas.1711463114

Experimental method

X-RAY DIFFRACTION (2.556 Å)