7T9O

HIV Integrase in complex with Compound-25

7T9O の概要

• エントリーDOI: 10.2210/pdb7t9o/pdb
• 分子名称: Integrase, SULFATE ION, (2S)-tert-butoxy[4-(4,4-dimethylpiperidin-1-yl)-5-{4-[2-(4-fluorophenyl)ethoxy]phenyl}-2,6-dimethylpyridin-3-yl]acetic acid, ... (5 entities in total)
• 機能のキーワード: dna integration, aids, rnaseh, ledgf, endonuclease, hiv-1 integrase, dna binding protein, viral protein
• 由来する生物種: Human immunodeficiency virus 1
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 20628.27

構造登録者

Khan, J.A.,Lewis, H.,Kish, K. (登録日: 2021-12-19, 公開日: 2022-04-06, 最終更新日: 2023-10-18)

• 主引用文献: Naidu, B.N.,Patel, M.,McAuliffe, B.,Ding, B.,Cianci, C.,Simmermacher, J.,Jenkins, S.,Parker, D.D.,Sivaprakasam, P.,Khan, J.A.,Kish, K.,Lewis, H.,Hanumegowda, U.,Krystal, M.,Meanwell, N.A.,Kadow, J.F.; Design, Synthesis, and Preclinical Profiling of GSK3739936 (BMS-986180), an Allosteric Inhibitor of HIV-1 Integrase with Broad-Spectrum Activity toward 124/125 Polymorphs.; J.Med.Chem., 65:4949-4971, 2022; PubMed: 35235334; DOI: 10.1021/acs.jmedchem.1c02169

実験手法

X-RAY DIFFRACTION (1.95 Å)