6CIR

Human Cytochrome P450 17A1 in complex with inhibitor: abiraterone C6 oxime

Summary for 6CIR

Entry DOI	10.2210/pdb6cir/pdb
Descriptor	Steroid 17-alpha-hydroxylase/17,20 lyase, PROTOPORPHYRIN IX CONTAINING FE, 6-oxime-17-(3-pyridyl)-androst-16-en-3-ol, ... (4 entities in total)
Functional Keywords	cytochrome p450, p450, cyp17a1, p450c17, p450 17a1, monooxygenase, 17a-hydroxylase, 17, 20-lyase, heme protein, cytochrome p450 oxidoreductase, membrane, microsome, endoplasmic reticulum, oxidoreductase-oxidoreductase inhibitor, oxidoreductase, oxidoreductase-oxidoreductase inhibitor complex, oxidoreductase/oxidoreductase inhibitor
Biological source	Homo sapiens (Human)
Total number of polymer chains	4
Total formula weight	226948.60
Authors	Scott, E.E.,Fehl, C. (deposition date: 2018-02-25, release date: 2018-06-06, Last modification date: 2023-10-04)
Primary citation	Fehl, C.,Vogt, C.D.,Yadav, R.,Li, K.,Scott, E.E.,Aube, J. Structure-Based Design of Inhibitors with Improved Selectivity for Steroidogenic Cytochrome P450 17A1 over Cytochrome P450 21A2. J. Med. Chem., 61:4946-4960, 2018 Cited by PubMed: 29792703 DOI: 10.1021/acs.jmedchem.8b00419 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.648 Å)

Structure validation