9MS1 | pdb_00009ms1

Crystal structure of human CYP3A4 in complex with SJYHJ-111

External Resource: Annotation

Gene Ontology: Gene Product Annotation
InterPro: Protein Family Classification
Pharos: Disease Associations

Gene Ontology: Gene Product Annotation Gene Ontology Database Homepage

Chains	Polymer	Molecular Function	Biological Process	Cellular Component
A	Cytochrome P450 3A4	oxidoreductase activity catalytic activity vitamin D 24-hydroxylase activity monooxygenase activity steroid hydroxylase activity anandamide 8,9 epoxidase activity oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, NAD(P)H as one donor, and incorporation of one atom of oxygen anandamide epoxidase activity estrogen 16-alpha-hydroxylase activity oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, reduced flavin or flavoprotein as one donor, and incorporation of one atom of oxygen 1,8-cineole 2-exo-monooxygenase activity vitamin D 23-hydroxylase activity 1-alpha,25-dihydroxyvitamin D3 23-hydroxylase activity oxidoreductase activity catalytic activity vitamin D 24-hydroxylase activity monooxygenase activity steroid hydroxylase activity anandamide 8,9 epoxidase activity oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, NAD(P)H as one donor, and incorporation of one atom of oxygen anandamide epoxidase activity estrogen 16-alpha-hydroxylase activity oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen, reduced flavin or flavoprotein as one donor, and incorporation of one atom of oxygen 1,8-cineole 2-exo-monooxygenase activity vitamin D 23-hydroxylase activity 1-alpha,25-dihydroxyvitamin D3 23-hydroxylase activity vitamin D3 25-hydroxylase activity quinine 3-monooxygenase activity anandamide 11,12 epoxidase activity oxygen binding binding small molecule binding estrogen 2-hydroxylase activity retinoic acid 4-hydroxylase activity anandamide 14,15 epoxidase activity oxidoreductase activity, acting on CH or CH2 groups, quinone or similar compound as acceptor caffeine oxidase activity oxidoreductase activity, acting on CH or CH2 groups testosterone 6-beta-hydroxylase activity tetrapyrrole binding heme binding cation binding transition metal ion binding iron ion binding ion binding metal ion binding steroid binding lipid binding protein binding enzyme binding	oxidative demethylation demethylation metabolic process cellular process lipid modification primary metabolic process lipid hydroxylation lipid metabolic process diterpenoid metabolic process oxoacid metabolic process regulation of hormone levels biological regulation carboxylic acid metabolic process organic acid metabolic process oxidative demethylation demethylation metabolic process cellular process lipid modification primary metabolic process lipid hydroxylation lipid metabolic process diterpenoid metabolic process oxoacid metabolic process regulation of hormone levels biological regulation carboxylic acid metabolic process organic acid metabolic process hormone metabolic process retinoic acid metabolic process retinoid metabolic process small molecule metabolic process regulation of biological quality monocarboxylic acid metabolic process terpenoid metabolic process isoprenoid metabolic process steroid metabolic process androgen metabolic process aflatoxin metabolic process mycotoxin metabolic process toxin metabolic process secondary metabolic process catabolic process alkaloid catabolic process alkaloid metabolic process estrogen metabolic process secondary alcohol metabolic process sterol metabolic process cholesterol metabolic process alcohol metabolic process lipid catabolic process fat-soluble vitamin metabolic process vitamin D catabolic process vitamin D metabolic process fat-soluble vitamin catabolic process vitamin catabolic process vitamin metabolic process steroid catabolic process small molecule catabolic process cellular response to stimulus cellular response to chemical stimulus response to stimulus response to chemical cellular response to xenobiotic stimulus xenobiotic metabolic process response to xenobiotic stimulus xenobiotic catabolic process fatty acid metabolic process long-chain fatty acid metabolic process monocarboxylic acid biosynthetic process small molecule biosynthetic process long-chain fatty acid biosynthetic process lipid biosynthetic process organic acid biosynthetic process fatty acid biosynthetic process carboxylic acid biosynthetic process biosynthetic process monoterpenoid metabolic process olefinic compound metabolic process retinol metabolic process primary alcohol metabolic process	membrane-bounded organelle intracellular organelle cellular anatomical structure intracellular anatomical structure organelle intracellular membrane-bounded organelle cytoplasm organelle subcompartment membrane endomembrane system endoplasmic reticulum subcompartment nuclear outer membrane-endoplasmic reticulum membrane network endoplasmic reticulum organelle membrane membrane-bounded organelle intracellular organelle cellular anatomical structure intracellular anatomical structure organelle intracellular membrane-bounded organelle cytoplasm organelle subcompartment membrane endomembrane system endoplasmic reticulum subcompartment nuclear outer membrane-endoplasmic reticulum membrane network endoplasmic reticulum organelle membrane endoplasmic reticulum membrane

InterPro: Protein Family Classification InterPro Database Homepage

Chains	Accession	Name	Type
A	IPR008072	Cytochrome P450, E-class, CYP3A	Family
A	IPR002402	Cytochrome P450, E-class, group II	Family
A	IPR017972	Cytochrome P450, conserved site	Conserved Site
A	IPR050705	Cytochrome P450 3A	Family
A	IPR001128	Cytochrome P450	Family
A	IPR036396	Cytochrome P450 superfamily	Homologous Superfamily

Pharos: Disease Associations Pharos Homepage Annotation

Chains	Drug Target	Associated Disease
A	Pharos: P08684	osteosarcoma hepatitis C virus infection torsades de pointes breast carcinoma prostate cancer malignant ependymoma Mammary Neoplasms, Human pancreatic ductal adenocarcinoma adrenal cortex adenoma large cell medulloblastoma oligodendroglioma pancreatic intraductal papillary-mucinous neoplasm psoriasis astrocytic tumor cancer osteosarcoma hepatitis C virus infection torsades de pointes breast carcinoma prostate cancer malignant ependymoma Mammary Neoplasms, Human pancreatic ductal adenocarcinoma adrenal cortex adenoma large cell medulloblastoma oligodendroglioma pancreatic intraductal papillary-mucinous neoplasm psoriasis astrocytic tumor cancer diarrheal disease drug-induced liver injury liver disease schizophrenia breast cancer cutaneous lupus erythematosus HIV infectious disease

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.