5IBE
Crystal structure Mycobacterium tuberculosis CYP121 in complex with inhibitor fragment 25a
Summary for 5IBE
Entry DOI | 10.2210/pdb5ibe/pdb |
Descriptor | Mycocyclosin synthase, SULFATE ION, PROTOPORPHYRIN IX CONTAINING FE, ... (6 entities in total) |
Functional Keywords | mycobacterium tuberculosis, cyp121, fragment based inhibitor screening, oxidoreductase |
Biological source | Mycobacterium tuberculosis |
Total number of polymer chains | 1 |
Total formula weight | 44940.30 |
Authors | Levy, C. (deposition date: 2016-02-22, release date: 2016-04-06, Last modification date: 2024-05-01) |
Primary citation | Kavanagh, M.E.,Coyne, A.G.,McLean, K.J.,James, G.G.,Levy, C.W.,Marino, L.B.,de Carvalho, L.P.,Chan, D.S.,Hudson, S.A.,Surade, S.,Leys, D.,Munro, A.W.,Abell, C. Fragment-Based Approaches to the Development of Mycobacterium tuberculosis CYP121 Inhibitors. J.Med.Chem., 59:3272-3302, 2016 Cited by PubMed: 27002486DOI: 10.1021/acs.jmedchem.6b00007 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.624 Å) |
Structure validation
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