Brand  (β version)

PDB ID: 5ICM

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Ligands
Code Name Style Show Link
F45 [6-(3,4-dihydroxyphenyl)pyridin-2-yl](4-fluoro-3-hydroxyphenyl)methanone PoSSuM
NA Sodium ion PoSSuM
NAD Nicotinamide-adenine-dinucleotide PoSSuM
GLC Alpha-D-glucopyranose PoSSuM
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Structure summary

Code : 5ICM   PDBj   RCSB PDB   PDBe
Header : OXIDOREDUCTASE
Title : 17beta-hydroxysteroid dehydrogenase type 14 in complex with a non-steroidal inhibitor
Release Data : 2016-07-13
Compound :
mol_id molecule chains synonym
1 17-beta-hydroxysteroid dehydrogenase 14 A 17-beta-HSD 14,17-beta-hydroxysteroid dehydrogenase DHRS10,Dehydrogenase/reductase SDR family member 10,Retinal short-chain dehydrogenase/reductase retSDR3,Short chain dehydrogenase/reductase family 47C member 1
ec: 1.1.1.-
Source :
mol_id organism_scientific organism_common expression_system
1 Homo sapiens  (taxid:9606) Human Escherichia coli BL21  (taxid:511693)
gene: HSD17B14, DHRS10, SDR3, SDR47C1, UNQ502/PRO474
Authors : Bertoletti, N., Braun, F., Marchais-Oberwinkler, S., Heine, A., Klebe, G.
Keywords : hydroxysteroid dehydrogenase, inhibitor complex, oxidoreductase
Exp. method : X-RAY DIFFRACTION ( 1.680 Å )
Citation :

New Insights into Human 17 beta-Hydroxysteroid Dehydrogenase Type 14: First Crystal Structures in Complex with a Steroidal Ligand and with a Potent Nonsteroidal Inhibitor.

Bertoletti, N.,Braun, F.,Lepage, M.  et al.
(2016)  J.Med.Chem.  59 : 6961 - 6967

PubMed: 27362750
DOI: 10.1021/acs.jmedchem.6b00293

Reaction

Chain : A
UniProt : Q9BPX1 (DHB14_HUMAN)
Reaction: EC: Evidence:
Physiological Direction:
17beta-estradiol + NAD(+) = estrone + H(+) + NADH 1.1.1.62 PubMed:17067289
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androst-5-en-3beta,17beta-diol + NAD(+) = 3beta- hydroxyandrost-5-en-17-one + H(+) + NADH - PubMed:17067289
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