The crystal structure of wild type PA endonuclease (2009/H1N1/CALIFORNIA) in complex with SJ000986436

The crystal structure of wild type PA endonuclease (2009/H1N1/CALIFORNIA) in complex with SJ000986436 Descriptor: 5-hydroxy-N-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-6-oxo-2-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-4-carboxamide, Hexa Vinylpyrrolidone K15, MANGANESE (II) ION, ... Authors: Cuypers, M.G, Slavish, J.P, Rankovic, Z, White, S.W. Deposit date: 2021-05-04 Release date: 2022-05-04 Last modified: 2023-11-22 Method: X-RAY DIFFRACTION (2.8 Å) Cite: Chemical scaffold recycling: Structure-guided conversion of an HIV integrase inhibitor into a potent influenza virus RNA-dependent RNA polymerase inhibitor designed to minimize resistance potential. Eur.J.Med.Chem., 247, 2023

本数据集收录了野生型PA核酸内切酶（wild type PA endonuclease，2009/H1N1/加利福尼亚株）与SJ000986436结合形成复合物的晶体结构，该复合物的配体及辅助组分信息如下：5-羟基-N-[2-(4-羟基-3-甲氧基苯基)乙基]-6-氧代-2-[2-(三氟甲基)苯基]-1,6-二氢嘧啶-4-甲酰胺、六乙烯基吡咯烷酮K15以及锰(II)离子等。作者：Cuypers M.G.、Slavish J.P.、Rankovic Z.、White S.W.。提交日期：2021-05-04，发布日期：2022-05-04，最后修改日期：2023-11-22。实验方法：X射线衍射（X-RAY DIFFRACTION），分辨率2.8 Å。引用文献：《Chemical scaffold recycling: Structure-guided conversion of an HIV integrase inhibitor into a potent influenza virus RNA-dependent RNA polymerase inhibitor designed to minimize resistance potential》，发表于《欧洲药物化学杂志（European Journal of Medicinal Chemistry）》2023年第247卷。