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4H57

Thermolysin inhibition

Replaces:  3FWD
Summary for 4H57
Entry DOI10.2210/pdb4h57/pdb
Related3FV4 3FVP
Related PRD IDPRD_000654
DescriptorThermolysin, CALCIUM ION, ZINC ION, ... (7 entities in total)
Functional Keywordsprotease phosphonamidate inhibitor, metal-binding, metalloprotease, protease, secreted, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
Biological sourceBacillus thermoproteolyticus
Cellular locationSecreted: P00800
Total number of polymer chains1
Total formula weight35646.35
Authors
Englert, L.,Biela, A.,Heine, A.,Klebe, G. (deposition date: 2012-09-18, release date: 2012-10-03, Last modification date: 2023-09-20)
Primary citationBiela, A.,Nasief, N.N.,Betz, M.,Heine, A.,Hangauer, D.,Klebe, G.
Dissecting the hydrophobic effect on the molecular level: the role of water, enthalpy, and entropy in ligand binding to thermolysin.
Angew.Chem.Int.Ed.Engl., 52:1822-1828, 2013
Cited by
PubMed: 23283700
DOI: 10.1002/anie.201208561
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.56 Å)
Structure validation

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