PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000374420934

PanDDA analysis group deposition -- Crystal structure of SARS-CoV-2 NSP3 macrodomain in complex with ZINC000374420934 Descriptor: 4-(1,4-oxazonan-4-yl)-7H-pyrrolo[2,3-d]pyrimidine, Non-structural protein 3 Authors: Correy, G.J, Young, I.D, Thompson, M.C, Fraser, J.S. Deposit date: 2020-09-28 Release date: 2020-12-16 Last modified: 2024-05-22 Method: X-RAY DIFFRACTION (1.01 Å) Cite: Fragment binding to the Nsp3 macrodomain of SARS-CoV-2 identified through crystallographic screening and computational docking. Sci Adv, 7, 2021PanDDA分析组存档数据集——新型冠状病毒2型（SARS-CoV-2）非结构蛋白3（Non-structural protein 3, NSP3）宏结构域与配体ZINC000374420934的共晶结构，配体描述符为4-(1,4-氧杂氮杂环庚烷-4-基)-7H-吡咯并[2,3-d]嘧啶（4-(1,4-oxazonan-4-yl)-7H-pyrrolo[2,3-d]pyrimidine）。作者：Correy, G.J.、Young, I.D.、Thompson, M.C.、Fraser, J.S. 存档日期：2020-09-28 发布日期：2020-12-16 最后修改日期：2024-05-22 实验方法：X射线衍射（X-RAY DIFFRACTION），分辨率1.01埃（Å） 引用文献：通过晶体学筛选与计算机对接鉴定新型冠状病毒2型Nsp3宏结构域的片段结合物，《科学进展》（Sci Adv），7卷，2021年