3WZ6
Endothiapepsin in complex with Gewald reaction-derived inhibitor (5)
Summary for 3WZ6
| Entry DOI | 10.2210/pdb3wz6/pdb |
| Related | 3WZ7 3WZ8 |
| Descriptor | Endothiapepsin, ACETATE ION, TETRAETHYLENE GLYCOL, ... (7 entities in total) |
| Functional Keywords | aspartic protease, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor |
| Biological source | Cryphonectria parasitica (Chesnut blight fungus) |
| Total number of polymer chains | 1 |
| Total formula weight | 35313.58 |
| Authors | Kuhnert, M.,Steuber, H.,Diederich, W.E. (deposition date: 2014-09-19, release date: 2015-08-05, Last modification date: 2023-11-08) |
| Primary citation | Kuhnert, M.,Koster, H.,Bartholomaus, R.,Park, A.Y.,Shahim, A.,Heine, A.,Steuber, H.,Klebe, G.,Diederich, W.E. Tracing binding modes in hit-to-lead optimization: chameleon-like poses of aspartic protease inhibitors Angew.Chem.Int.Ed.Engl., 54:2849-2853, 2015 Cited by PubMed: 25630461DOI: 10.1002/anie.201411206 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (1.404 Å) |
Structure validation
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