5M9W
Experimental MAD phased structure of thermolysin in complex with inhibitor JC65.
Summary for 5M9W
| Entry DOI | 10.2210/pdb5m9w/pdb |
| Descriptor | Thermolysin, ZINC ION, CALCIUM ION, ... (7 entities in total) |
| Functional Keywords | hydrolase, metalloprotease, hydrolase inhibitor complex |
| Biological source | Bacillus thermoproteolyticus |
| Cellular location | Secreted: P00800 |
| Total number of polymer chains | 1 |
| Total formula weight | 35498.15 |
| Authors | Krimmer, S.G.,Cramer, J.,Heine, A.,Klebe, G. (deposition date: 2016-11-02, release date: 2017-08-16) |
| Primary citation | Krimmer, S.G.,Cramer, J.,Schiebel, J.,Heine, A.,Klebe, G. How Nothing Boosts Affinity: Hydrophobic Ligand Binding to the Virtually Vacated S1' Pocket of Thermolysin. J. Am. Chem. Soc., 139:10419-10431, 2017 Cited by PubMed: 28696673DOI: 10.1021/jacs.7b05028 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (1.21 Å) |
Structure validation
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