7SO2

Crystal Structure of HIV-1 Reverse Transcriptase Y181C Variant in Complex with (E)-4-((4-((4-(2-cyanovinyl)-2,6-dimethylphenyl)amino)-6-(3-morpholinopropoxy)-1,3,5-triazin-2-yl)amino)benzonitrile (JLJ564)

7SO2 の概要

• エントリーDOI: 10.2210/pdb7so2/pdb
• 関連するPDBエントリー: 7SNP 7SNZ 7SO1
• 分子名称: Reverse transcriptase/ribonuclease H, p51 RT, 4-[(4-{4-[(E)-2-cyanoethenyl]-2,6-dimethylanilino}-6-[3-(morpholin-4-yl)propoxy]-1,3,5-triazin-2-yl)amino]benzonitrile (3 entities in total)
• 機能のキーワード: polymerase, transferase, hydrolase, rnaseh, transferase-viral protein complex, transferase/viral protein
• 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: 114479.29

構造登録者

Frey, K.M.,Anderson, K.S. (登録日: 2021-10-29, 公開日: 2022-03-16, 最終更新日: 2023-10-18)

• 主引用文献: Frey, K.M.,Bertoletti, N.,Chan, A.H.,Ippolito, J.A.,Bollini, M.,Spasov, K.A.,Jorgensen, W.L.,Anderson, K.S.; Structural Studies and Structure Activity Relationships for Novel Computationally Designed Non-nucleoside Inhibitors and Their Interactions With HIV-1 Reverse Transcriptase.; Front Mol Biosci, 9:805187-805187, 2022; PubMed: 35237658; DOI: 10.3389/fmolb.2022.805187

実験手法

X-RAY DIFFRACTION (3.089 Å)