2JJP

Structure of cytochrome P450 EryK in complex with inhibitor ketoconazole (KC)

Summary for 2JJP

Related2WIO 2VRU 2JJN 2VRV 2JJO
DescriptorCYTOCHROME P450 113A1, PROTOPORPHYRIN IX CONTAINING FE, 1-ACETYL-4-(4-{[(2S,4R)-2-(2,4-DICHLOROPHENYL)-2-(1H-IMIDAZOL-1-YLMETHYL)-1,3-DIOXOLAN-4-YL]METHOXY}PHENYL)PIPERAZINE, ... (5 entities in total)
Functional Keywordsiron, heme, monooxygenase, metal-binding, antibiotic biosynthesis, tie-rod mechanism of action, oxidoreductase, substrate specificity
Biological sourceSACCHAROPOLYSPORA ERYTHRAEA
Total number of polymer chains1
Total molecular weight46687.08
Authors
Savino, C.,Sciara, G.,Miele, A.E.,Kendrew, S.G.,Vallone, B. (deposition date: 2008-04-15, release date: 2009-07-14, Last modification date: 2012-08-22)
Primary citation
Montemiglio, L.C.,Gianni, S.,Vallone, B.,Savino, C.
Azole Drugs Trap Cytochrome P450 Eryk in Alternative Conformational States.
Biochemistry, 49:9199-, 2010
PubMed: 20845962 (PDB entries with the same primary citation)
DOI: 10.1021/BI101062V
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (2.1 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.260131.0%7.6%8.8%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution