7QNN
Crystal structure of CYP125 from Mycobacterium tuberculosis in complex with inhibitor (surface entropy reduction mutant)
Summary for 7QNN
Entry DOI | 10.2210/pdb7qnn/pdb |
Descriptor | Steroid C26-monooxygenase, PROTOPORPHYRIN IX CONTAINING FE, ethyl 1-(cyclopentylmethyl)-5-pyridin-4-yl-indole-2-carboxylate, ... (4 entities in total) |
Functional Keywords | p450, cyp, tuberculosis, cholesterol, inhibitor, complex, surface, entropy, reduction, cytochrome, oxidoreductase |
Biological source | Mycobacterium tuberculosis |
Total number of polymer chains | 1 |
Total formula weight | 47454.00 |
Authors | Snee, M.,Tunnicliffe, R.,Leys, D.,Levy, C.,Katariya, M. (deposition date: 2021-12-21, release date: 2022-12-28, Last modification date: 2024-02-07) |
Primary citation | Katariya, M.M.,Snee, M.,Tunnicliffe, R.B.,Kavanagh, M.E.,Boshoff, H.I.M.,Amadi, C.N.,Levy, C.W.,Munro, A.W.,Abell, C.,Leys, D.,Coyne, A.G.,McLean, K.J. Structure Based Discovery of Inhibitors of CYP125 and CYP142 from Mycobacterium tuberculosis. Chemistry, 29:e202203868-e202203868, 2023 Cited by PubMed: 36912255DOI: 10.1002/chem.202203868 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.47 Å) |
Structure validation
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