PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with NCL-00023833

PanDDA analysis group deposition -- Crystal Structure of PHIP in complex with NCL-00023833 Descriptor: 4-bromanyl-1,8-naphthyridine, PH-interacting protein Authors: Grosjean, H, Aimon, A, Krojer, T, Talon, R, Douangamath, A, Koekemoer, L, Arrowsmith, C.H, Edwards, A, Bountra, C, von Delft, F, Biggin, P.C. Deposit date: 2020-06-02 Release date: 2020-06-17 Last modified: 2026-02-18 Method: X-RAY DIFFRACTION (1.151 Å) Cite: SAMPL7 protein-ligand challenge: A community-wide evaluation of computational methods against fragment screening and pose-prediction. J.Comput.Aided Mol.Des., 36, 2022

PanDDA分析团队提交存档——与配体NCL-00023833结合的PHIP蛋白（PH结构域相互作用蛋白，PH-interacting protein）晶体结构，其配体描述符为4-溴-1,8-萘啶。作者：Grosjean, H、Aimon, A、Krojer, T、Talon, R、Douangamath, A、Koekemoer, L、Arrowsmith, C.H、Edwards, A、Bountra, C、von Delft, F、Biggin, P.C.。提交日期：2020-06-02；发布日期：2020-06-17；最后更新日期：2026-02-18。解析方法：X射线衍射（分辨率1.151埃）。引用文献：SAMPL7蛋白质-配体挑战：针对片段筛选与构象预测的全社区计算方法评估。《计算机辅助分子设计杂志》，36卷，2022年。