5MMP
E. coli DNA Gyrase B 24 kDa ATPase domain in complex with 1-ethyl-3-[5-pyridin-4-yl-8-(pyridin-3-ylamino)-isoquinolin-3-yl]-urea
Summary for 5MMP
Entry DOI | 10.2210/pdb5mmp/pdb |
Descriptor | DNA gyrase subunit B, 1-ethyl-3-[5-pyridin-4-yl-8-(pyridin-3-ylamino)isoquinolin-3-yl]urea (3 entities in total) |
Functional Keywords | inhibitor, 009, isomerase |
Biological source | Escherichia coli O157:H7 |
Cellular location | Cytoplasm : P0AES7 |
Total number of polymer chains | 1 |
Total formula weight | 26260.47 |
Authors | Panchaud, P.,Bruyere, T.,Blumstein, A.-C.,Bur, D.,Chambovey, A.,Ertel, E.A.,Gude, M.,Hubschwerlen, C.,Jacob, L.,Kimmerlin, T.,Pfeifer, T.,Prade, L.,Seiler, P.,Ritz, D.,Rueedi, G. (deposition date: 2016-12-12, release date: 2017-04-26, Last modification date: 2024-05-08) |
Primary citation | Panchaud, P.,Bruyere, T.,Blumstein, A.C.,Bur, D.,Chambovey, A.,Ertel, E.A.,Gude, M.,Hubschwerlen, C.,Jacob, L.,Kimmerlin, T.,Pfeifer, T.,Prade, L.,Seiler, P.,Ritz, D.,Rueedi, G. Discovery and Optimization of Isoquinoline Ethyl Ureas as Antibacterial Agents. J. Med. Chem., 60:3755-3775, 2017 Cited by PubMed: 28406299DOI: 10.1021/acs.jmedchem.6b01834 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.05 Å) |
Structure validation
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