3DYA

HIV-1 RT with non-nucleoside inhibitor annulated Pyrazole 1

3DYA の概要

• エントリーDOI: 10.2210/pdb3dya/pdb
• 関連するPDBエントリー: 3E01
• 分子名称: REVERSE TRANSCRIPTASE/RIBONUCLEASE H, p51 RT, 3-[6-bromo-2-fluoro-3-(1H-pyrazolo[3,4-c]pyridazin-3-ylmethyl)phenoxy]-5-chlorobenzonitrile, ... (4 entities in total)
• 機能のキーワード: pr160gag-pol, reverse transcriptase/ribonuclease h, p66 rt, p51 rt, transferase
• 由来する生物種: HIV-1 M:B_HXB2R (HIV-1); 詳細
• 細胞内の位置: 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
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 116567.84

構造登録者

Harris, S.F.,Villasenor, A. (登録日: 2008-07-25, 公開日: 2008-11-25, 最終更新日: 2024-02-21)

• 主引用文献: Sweeney, Z.K.,Harris, S.F.,Arora, S.F.,Javanbakht, H.,Li, Y.,Fretland, J.,Davidson, J.P.,Billedeau, J.R.,Gleason, S.K.,Hirschfeld, D.,Kennedy-Smith, J.J.,Mirzadegan, T.,Roetz, R.,Smith, M.,Sperry, S.,Suh, J.M.,Wu, J.,Tsing, S.,Villasenor, A.G.,Paul, A.,Su, G.,Heilek, G.,Hang, J.Q.,Zhou, A.S.,Jernelius, J.A.,Zhang, F.J.,Klumpp, K.; Design of annulated pyrazoles as inhibitors of HIV-1 reverse transcriptase; J.Med.Chem., 51:7449-7458, 2008; PubMed: 19007201; DOI: 10.1021/jm800527x

実験手法

X-RAY DIFFRACTION (2.3 Å)