5TUQ

Crystal Structure of a 6-Cyclohexylmethyl-3-hydroxypyrimidine-2,4-dione Inhibitor in Complex with HIV Reverse Transcriptase

5TUQ の概要

• エントリーDOI: 10.2210/pdb5tuq/pdb
• 分子名称: HIV-1 REVERSE TRANSCRIPTASE, 1-[(benzyloxy)methyl]-6-(cyclohexylmethyl)-3-hydroxy-5-(propan-2-yl)pyrimidine-2,4(1H,3H)-dione, MAGNESIUM ION, ... (5 entities in total)
• 機能のキーワード: hiv-1, reverse transcriptase, inhibitor, transferase-transferase inhibitor complex, transferase/transferase 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: 114612.77

構造登録者

Kirby, K.A.,Sarafianos, S.G. (登録日: 2016-11-07, 公開日: 2017-06-28, 最終更新日: 2023-10-04)

• 主引用文献: Tang, J.,Kirby, K.A.,Huber, A.D.,Casey, M.C.,Ji, J.,Wilson, D.J.,Sarafianos, S.G.,Wang, Z.; 6-Cyclohexylmethyl-3-hydroxypyrimidine-2,4-dione as an inhibitor scaffold of HIV reverase transcriptase: Impacts of the 3-OH on inhibiting RNase H and polymerase.; Eur J Med Chem, 128:168-179, 2017; PubMed: 28182989; DOI: 10.1016/j.ejmech.2017.01.041

実験手法

X-RAY DIFFRACTION (2.705 Å)