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TitleDesign of pyrozolo-pyrimidines as 11beta-HSD1 inhibitors through optimisation of molecular electrostatic potential.
Journal, issue, pagesMedchemcomm, Vol. 6, Page 926-934, Year 2016
Publish dateMar 24, 2015 (structure data deposition date)
AuthorsRobb, G.R. / Boyd, S. / Davies, C.D. / Dossiter, A.G. / Goldberg, F.W. / Kemmitt, P.D. / Scott, J.S. / Swales, J.G.
External linksMedchemcomm / Search PubMed
MethodsX-ray diffraction
Resolution3.2 Å
Structure data

PDB-4yyz:
11B-HYDROXYSTEROID DEHYDROGENASE TYPE I IN COMPLEX WITH INHIBITOR
Method: X-RAY DIFFRACTION / Resolution: 3.2 Å

Chemicals

ChemComp-NAP:
NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE

ChemComp-4JX:
N-[(1R,2s,3S,5s,7s)-5-hydroxytricyclo[3.3.1.1~3,7~]dec-2-yl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide

Source
  • homo sapiens (human)
KeywordsOXIDOREDUCTASE / DEHYDROGENASE INHIBITOR / BHSD

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