5N2X
Thermolysin in complex with inhibitor JC272
Summary for 5N2X
Entry DOI | 10.2210/pdb5n2x/pdb |
Descriptor | Thermolysin, ZINC ION, CALCIUM ION, ... (7 entities in total) |
Functional Keywords | inhibitor, phosphonamidate, protease, hydrolase |
Biological source | Bacillus thermoproteolyticus |
Cellular location | Secreted: P00800 |
Total number of polymer chains | 1 |
Total formula weight | 35411.10 |
Authors | Cramer, J.,Krimmer, S.G.,Heine, A.,Klebe, G. (deposition date: 2017-02-08, release date: 2017-06-21, Last modification date: 2024-01-17) |
Primary citation | Cramer, J.,Krimmer, S.G.,Heine, A.,Klebe, G. Paying the Price of Desolvation in Solvent-Exposed Protein Pockets: Impact of Distal Solubilizing Groups on Affinity and Binding Thermodynamics in a Series of Thermolysin Inhibitors. J. Med. Chem., 60:5791-5799, 2017 Cited by PubMed: 28590130DOI: 10.1021/acs.jmedchem.7b00490 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.209 Å) |
Structure validation
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