5IBF

Crystal structure Mycobacterium tuberculosis CYP121 in complex with inhibitor fragment 19a

Summary for 5IBF

Entry DOI	10.2210/pdb5ibf/pdb
Descriptor	Mycocyclosin synthase, SULFATE ION, PROTOPORPHYRIN IX CONTAINING FE, ... (5 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	44519.01
Authors	Levy, C. (deposition date: 2016-02-22, release date: 2016-04-06, Last modification date: 2019-10-16)
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: 27002486 DOI: 10.1021/acs.jmedchem.6b00007 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.7 Å)

Structure validation