5VQR

Crystal Structure of HIV-1 Reverse Transcriptase in Complex with N-(6-cyano-3-(2-(2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy)phenoxy)-4-methylnaphthalen-1-yl)-N-methylacrylamide (JLJ684), a Non-nucleoside Inhibitor

5VQR の概要

• エントリーDOI: 10.2210/pdb5vqr/pdb
• 関連するPDBエントリー: 5TER 5VQQ 5VQS 5VQT 5VQU 5VQV 5VQW 5VQX 5VQY 5VQZ
• 分子名称: Reverse transcriptase/ribonuclease H, p51 RT, N-(6-cyano-3-{2-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenoxy}-4-methylnaphthalen-1-yl)-N-methylprop-2-enamide, ... (5 entities in total)
• 機能のキーワード: polymerase, reverse transcriptase, non-nucleoside inhibitor, transferase-hydrolase-inhibitor complex, transferase/hydrolase/inhibitor
• 由来する生物種: Human immunodeficiency virus type 1 group M subtype B (isolate BH10) (HIV-1); 詳細
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 114621.30

構造登録者

Chan, A.H.,Anderson, K.S. (登録日: 2017-05-09, 公開日: 2017-08-23, 最終更新日: 2023-10-04)

• 主引用文献: 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

実験手法

X-RAY DIFFRACTION (2.55 Å)