2MLM
Solution structure of sortase A from S. aureus in complex with benzo[d]isothiazol-3-one based inhibitor
Summary for 2MLM
Entry DOI | 10.2210/pdb2mlm/pdb |
NMR Information | BMRB: 19826 |
Descriptor | Sortase family protein, N-{2-oxo-2-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-ylamino]ethyl}-2-sulfanylbenzamide (2 entities in total) |
Functional Keywords | hydrolase/hydrolase inhibitor, hydrolase-hydrolase inhibitor complex |
Biological source | Staphylococcus aureus |
Total number of polymer chains | 1 |
Total formula weight | 17169.53 |
Authors | Jaudzems, K.,Zhulenkovs, D.,Leonchiks, A. (deposition date: 2014-03-03, release date: 2014-11-19, Last modification date: 2018-06-27) |
Primary citation | Zhulenkovs, D.,Rudevica, Z.,Jaudzems, K.,Turks, M.,Leonchiks, A. Discovery and structure-activity relationship studies of irreversible benzisothiazolinone-based inhibitors against Staphylococcus aureus sortase A transpeptidase. Bioorg.Med.Chem., 22:5988-6003, 2014 Cited by PubMed: 25282649DOI: 10.1016/j.bmc.2014.09.011 PDB entries with the same primary citation |
Experimental method | SOLUTION NMR |
Structure validation
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