Endothiapepsin crystal B05a from ECBL-96 fragment library screening campaign used for PanDDA ground state calculation

Endothiapepsin crystal B05a from ECBL-96 fragment library screening campaign used for PanDDA ground state calculation Descriptor: Endothiapepsin Authors: Wollenhaupt, J, Benz, L.S, Jirgensons, A, Miletic, T, Mueller, U, Weiss, M.S. Deposit date: 2025-06-05 Release date: 2025-11-05 Last modified: 2025-12-31 Method: X-RAY DIFFRACTION (1.13 Å) Cite: From fragments to follow-ups: rapid hit expansion by making use of EU-OPENSCREEN resources. Rsc Med Chem, 16, 2025

本数据集源自ECBL-96片段库筛选项目中用于PanDDA基态计算的内孢霉蛋白酶（Endothiapepsin）晶体B05a。研究对象：内孢霉蛋白酶；作者：Wollenhaupt, J、Benz, L.S、Jirgensons, A、Miletic, T、Mueller, U、Weiss, M.S.；提交日期：2025-06-05；发布日期：2025-11-05；最后修改日期：2025-12-31；实验方法：X射线衍射（X-RAY DIFFRACTION），分辨率1.13埃；引用文献：From fragments to follow-ups: rapid hit expansion by making use of EU-OPENSCREEN resources. Rsc Med Chem, 16, 2025，该文献可译为《利用EU-OPENSCREEN资源实现从片段到后续研发的快速命中物拓展》，发表于《RSC Medicinal Chemistry》2025年第16卷。