4KIW
Design and structural analysis of aromatic inhibitors of type II dehydroquinate dehydratase from Mycobacterium tuberculosis - compound 49e [5-[(3-nitrobenzyl)amino]benzene-1,3-dicarboxylic acid]
Summary for 4KIW
| Entry DOI | 10.2210/pdb4kiw/pdb |
| Related | 4KI7 4KIJ 4KIM 4KIU 4KL9 4KLX 4KM0 4KM2 |
| Descriptor | 3-dehydroquinate dehydratase, 5-[(3-nitrobenzyl)amino]benzene-1,3-dicarboxylic acid (3 entities in total) |
| Functional Keywords | dehydratase, lyase-lyase inhibitor complex, lyase/lyase inhibitor |
| Biological source | Mycobacterium tuberculosis |
| Total number of polymer chains | 24 |
| Total formula weight | 438461.12 |
| Authors | Dias, M.V.B.,Howard, N.G.,Blundell, T.L.,Abell, C. (deposition date: 2013-05-02, release date: 2014-05-14, Last modification date: 2024-02-28) |
| Primary citation | Howard, N.I.,Dias, M.V.,Peyrot, F.,Chen, L.,Schmidt, M.F.,Blundell, T.L.,Abell, C. Design and Structural Analysis of Aromatic Inhibitors of Type II Dehydroquinase from Mycobacterium tuberculosis. Chemmedchem, 10:116-133, 2015 Cited by PubMed: 25234229DOI: 10.1002/cmdc.201402298 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (2.57 Å) |
Structure validation
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