4fam Summary


Crystal structure of human 17beta-hydroxysteroid dehydrogenase type 5 in complex with 3-((3,4-dihydroisoquinolin-2(1H)-yl)sulfonyl)benzoic acid (17)

The structure was published by Jamieson, S.M., Brooke, D.G., Heinrich, D., et al., Raynham, T., Flanagan, J.U., and Denny, W.A., in 2012 in a paper entitled "3-(3,4-Dihydroisoquinolin-2(1H)-ylsulfonyl)benzoic acids; a New Class of Highly Potent and Selective Inhibitors of the Type 5 17-beta-hydroxysteroid Dehydrogenase AKR1C3" (abstract).

This crystal structure was determined using X-ray diffraction at a resolution of 2.0 Å and deposited in 2012.

The experimental data on which the structure is based was also deposited.

This PDB entry contains multiple copies of the structure of Aldo-keto reductase family 1 member C3.

It also contains one or more heterogenic compounds (e.g., ligands, co-factors, ions, modified amino acids, etc.); see here for a complete list.

The molecule has more than one probable quaternary state observed. For more details see the quaternary structure page.

The following tables show cross-reference information to other databases (to obtain a list of all PDB entries sharing the same property or classification, click on the magnifying glass icon):

Chain Name UniProt Name of source organism % of UniProt sequence present in the sample Residues in the sample molecules % of residues observed
A Aldo-keto reductase family 1 member C3 P42330 (1-323) (AK1C3_HUMAN)search Homo sapienssearch 100% 331 95%
B Aldo-keto reductase family 1 member C3 P42330 (1-323) (AK1C3_HUMAN)search Homo sapienssearch 100% 331 95%

This entry contains 1 unique UniProt protein:

UniProt accession Name Organism PDB
P42330 (1 - 323) Aldo-keto reductase family 1 member C3 Homo sapiens

Chain Sequence family (Pfam)
A, B (P42330) PF00248: Aldo/keto reductase familysearch

Chain ID Molecular function (GO) Biological process (GO) Cellular component (GO)
A, B (P42330) oxidoreductase activitysearch retinol dehydrogenase activitysearch oxidoreductase activity, acting on NAD(P)H, quinone or similar compound as acceptorsearch trans-1,2-dihydrobenzene-1,2-diol dehydrogenase activitysearch testosterone 17-beta-dehydrogenase (NADP+) activitysearch ketoreductase activitysearch aldo-keto reductase (NADP) activitysearch phenanthrene 9,10-monooxygenase activitysearch 15-hydroxyprostaglandin-D dehydrogenase (NADP+) activitysearch androsterone dehydrogenase activitysearch retinal dehydrogenase activitysearch prostaglandin F receptor activitysearch testosterone dehydrogenase (NAD+) activitysearch dihydrotestosterone 17-beta-dehydrogenase activitysearch geranylgeranyl reductase activitysearch delta4-3-oxosteroid 5beta-reductase activitysearch prostaglandin D2 11-ketoreductase activitysearch prostaglandin-F synthase activitysearch indanol dehydrogenase activitysearch ketosteroid monooxygenase activitysearch alditol:NADP+ 1-oxidoreductase activitysearch oxidation-reduction processsearch small molecule metabolic processsearch cellular response to cadmium ionsearch cellular response to starvationsearch cellular response to reactive oxygen speciessearch prostaglandin metabolic processsearch positive regulation of cell proliferationsearch negative regulation of retinoic acid biosynthetic processsearch farnesol catabolic processsearch cellular response to corticosteroid stimulussearch progesterone metabolic processsearch positive regulation of reactive oxygen species metabolic processsearch positive regulation of protein kinase B signalingsearch cellular response to prostaglandin stimulussearch male gonad developmentsearch cellular response to calcium ionsearch daunorubicin metabolic processsearch phototransduction, visible lightsearch multicellular organismal macromolecule metabolic processsearch response to nutrientsearch testosterone biosynthetic processsearch regulation of testosterone biosynthetic processsearch steroid metabolic processsearch protein import into nucleus, translocationsearch regulation of retinoic acid receptor signaling pathwaysearch positive regulation of endothelial cell apoptotic processsearch response to prostaglandinsearch G-protein coupled receptor signaling pathwaysearch cyclooxygenase pathwaysearch arachidonic acid metabolic processsearch renal absorptionsearch cellular response to jasmonic acid stimulussearch keratinocyte differentiationsearch retinoid metabolic processsearch positive regulation of cell deathsearch doxorubicin metabolic processsearch retinal metabolic processsearch cytosolsearch cytoplasmsearch nucleussearch intracellularsearch extracellular vesicular exosomesearch

Chain InterPro annotation
A, B Aldo/keto reductasesearch Aldo/keto reductase, conserved sitesearch Aldo/keto reductase subgroupsearch NADP-dependent oxidoreductase domainsearch