6TET

The structure of CYP121 in complex with inhibitor L21

Summary for 6TET

• Entry DOI: 10.2210/pdb6tet/pdb
• Descriptor: Mycocyclosin synthase, 1,2-ETHANEDIOL, 1-[(~{E})-3-[4-(4-fluorophenyl)phenyl]prop-2-enyl]imidazole, ... (6 entities in total)
• Functional Keywords: cyp121, complex, inhibitor, oxidoreductase
• Biological source: Mycobacterium tuberculosis
• Total number of polymer chains: 1
• Total formula weight: 44723.26

Authors

Adam, S.,Koehnke, J. (deposition date: 2019-11-12, release date: 2021-05-26, Last modification date: 2024-01-24)

• Primary citation: Walter, I.,Adam, S.,Gentilini, M.V.,Kany, A.M.,Brengel, C.,Thomann, A.,Sparwasser, T.,Kohnke, J.,Hartmann, R.W.; Structure-Activity Relationship and Mode-Of-Action Studies Highlight 1-(4-Biphenylylmethyl)-1H-imidazole-Derived Small Molecules as Potent CYP121 Inhibitors.; Chemmedchem, 16:2786-2801, 2021; PubMed: 34010508; DOI: 10.1002/cmdc.202100283

Experimental method

X-RAY DIFFRACTION (1.49986889071 Å)