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-Structure paper
Title | Structures of endothiapepsin-fragment complexes from crystallographic fragment screening using a novel, diverse and affordable 96-compound fragment library. |
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Journal, issue, pages | Acta Crystallogr. ,Sect. F, Vol. 72, Page 346-355, Year 2016 |
Publish date | Feb 10, 2015 (structure data deposition date) |
![]() | Huschmann, F.U. / Linnik, J. / Sparta, K. / Uhlein, M. / Wang, X. / Metz, A. / Schiebel, J. / Heine, A. / Klebe, G. / Weiss, M.S. / Mueller, U. |
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Methods | X-ray diffraction |
Resolution | 1.03 - 1.439 Å |
Structure data | ![]() PDB-4y38: ![]() PDB-4y3j: ![]() PDB-4y3y: ![]() PDB-4y48: ![]() PDB-4y4d: ![]() PDB-4y4g: ![]() PDB-4y4j: ![]() PDB-4ze6: ![]() PDB-4zea: |
Chemicals | ![]() ChemComp-GOL: ![]() ChemComp-ACT: ![]() ChemComp-DMS: ![]() ChemComp-0A9: ![]() ChemComp-HOH: ![]() ChemComp-HIC: ![]() ChemComp-DCL: ![]() ChemComp-GLY: ![]() ChemComp-PRO: ![]() ChemComp-CFF: ![]() ChemComp-GGB: ![]() ChemComp-LNR: ![]() ChemComp-011: ![]() ChemComp-EDO: ![]() ChemComp-IMI: |
Source |
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![]() | HYDROLASE / fragment screening / aspartic protease inhibition / inhibition |