PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 main protease in complex with Z316425948_minor

PanDDA analysis group deposition -- Crystal Structure of SARS-CoV-2 main protease in complex with Z316425948_minor Descriptor: 1-(4-methylpiperazin-1-yl)-2-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethan-1-one, 3C-like proteinase, DIMETHYL SULFOXIDE Authors: Fearon, D, Owen, C.D, Douangamath, A, Lukacik, P, Powell, A.J, Strain-Damerell, C.M, Resnick, E, Krojer, T, Gehrtz, P, Wild, C, Aimon, A, Brandao-Neto, J, Carbery, A, Dunnett, L, Skyner, R, Snee, M, London, N, Walsh, M.A, von Delft, F. Deposit date: 2020-03-15 Release date: 2020-03-25 Last modified: 2026-02-18 Method: X-RAY DIFFRACTION (1.54 Å) Cite: Crystallographic and electrophilic fragment screening of the SARS-CoV-2 main protease. Nat Commun, 11, 2020

PanDDA分析组存档——严重急性呼吸综合征冠状病毒2（SARS-CoV-2）主蛋白酶与Z316425948_minor复合物的晶体结构。描述符：1-(4-甲基哌嗪-1-基)-2-(1H-吡咯并[2,3-b]吡啶-3-基)乙-1-酮、3C样蛋白酶、二甲基亚砜（Dimethyl Sulfoxide）。作者：Fearon, D.、Owen, C.D.、Douangamath, A.、Lukacik, P.、Powell, A.J.、Strain-Damerell, C.M.、Resnick, E.、Krojer, T.、Gehrtz, P.、Wild, C.、Aimon, A.、Brandao-Neto, J.、Carbery, A.、Dunnett, L.、Skyner, R.、Snee, M.、London, N.、Walsh, M.A.、von Delft, F.。存档日期：2020-03-15；发布日期：2020-03-25；最后修改日期：2026-02-18。实验方法：X射线衍射（X-RAY DIFFRACTION，1.54 Å）。引用文献：《SARS-CoV-2主蛋白酶的晶体学与亲电片段筛选》，《自然-通讯》（Nat Commun），第11卷，2020年