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TitleOxaprozin Analogues as Selective RXR Agonists with Superior Properties and Pharmacokinetics.
Journal, issue, pagesJ. Med. Chem., Vol. 64, Page 5123-5136, Year 2021
Publish dateDec 12, 2020 (structure data deposition date)
AuthorsSchierle, S. / Chaikuad, A. / Lillich, F.F. / Ni, X. / Woltersdorf, S. / Schallmayer, E. / Renelt, B. / Ronchetti, R. / Knapp, S. / Proschak, E. / Merk, D.
External linksJ. Med. Chem. / PubMed:33793232
MethodsX-ray diffraction
Resolution2.05 - 2.38 Å
Structure data

PDB-7b88:
Crystal structure of Retinoic Acid Receptor alpha (RXRA) in complexed with S99 inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.38 Å

PDB-7b9o:
Crystal structure of Retinoic Acid Receptor alpha (RXRA) in complexed with S169 inhibitor
Method: X-RAY DIFFRACTION / Resolution: 2.05 Å

Chemicals

ChemComp-T2K:
3-[5-[3,5-bis(chloranyl)phenyl]-4-phenyl-1,3-oxazol-2-yl]propanoic acid

ChemComp-HOH:
WATER

ChemComp-T72:
3-(5-(3,5-bis(trifluoromethyl)phenyl)-4-phenyloxazol-2-yl)propanoic acid

Source
  • homo sapiens (human)
KeywordsDNA BINDING PROTEIN / RXR alpha / RXRA / inhibitor / Structural Genomics / Structural Genomics Consortium / SGC / complex

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