4JVN

Crystal structure of human estrogen sulfotransferase (SULT1E1) in complex with inactive cofactor PAP and metabolite of brominated flame retardant 3OH BDE47 (3-hydroxyl bromodiphenyl ether)

Summary for 4JVN

Entry DOI	10.2210/pdb4jvn/pdb
Related	1G3M 4JVL 4JVM
Descriptor	Estrogen sulfotransferase, 2,6-dibromo-3-(2,4-dibromophenoxy)phenol, ADENOSINE-3'-5'-DIPHOSPHATE, ... (6 entities in total)
Functional Keywords	sulfotransferase, transferase
Biological source	Homo sapiens (human)
Cellular location	Cytoplasm: P49888
Total number of polymer chains	2
Total formula weight	72440.82
Authors	Gosavi, R.A.,Knudsen, G.A.,Birnbaum, L.S.,Pedersen, L.C. (deposition date: 2013-03-25, release date: 2013-09-04, Last modification date: 2023-09-20)
Primary citation	Gosavi, R.A.,Knudsen, G.A.,Birnbaum, L.S.,Pedersen, L.C. Mimicking of Estradiol Binding by Flame Retardants and Their Metabolites: A Crystallographic Analysis. Environ.Health Perspect., 121:1194-1199, 2013 Cited by PubMed Abstract: Brominated flame retardants (BFRs), used in many types of consumer goods, are being studied because of concerns about possible health effects related to endocrine disruption, immunotoxicity, reproductive toxicity, and neurotoxicity. Tetrabromobisphenol A (TBBPA), the most widely used BFR, and human metabolites of certain congeners of polybrominated diphenyl ether (e.g., 3-OH-BDE-47) have been suggested to inhibit estrogen sulfotransferase, potentially affecting estrogen metabolism. PubMed: 23959441 DOI: 10.1289/ehp.1306902 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (2.05 Å)

Structure validation