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TitleCharacterization of RA839, a Noncovalent Small Molecule Binder to Keap1 and Selective Activator of Nrf2 Signaling.
Journal, issue, pagesJ. Biol. Chem., Vol. 290, Page 28446-28455, Year 2015
Publish dateJul 9, 2015 (structure data deposition date)
AuthorsWinkel, A.F. / Engel, C.K. / Margerie, D. / Kannt, A. / Szillat, H. / Glombik, H. / Kallus, C. / Ruf, S. / Gussregen, S. / Riedel, J. ...Winkel, A.F. / Engel, C.K. / Margerie, D. / Kannt, A. / Szillat, H. / Glombik, H. / Kallus, C. / Ruf, S. / Gussregen, S. / Riedel, J. / Herling, A.W. / von Knethen, A. / Weigert, A. / Brune, B. / Schmoll, D.
External linksJ. Biol. Chem. / PubMed:26459563
MethodsX-ray diffraction
Resolution3.36 Å
Structure data

PDB-5cgj:
Crystal structure of murine Keap1 in complex with RA839, a non-covalent small-molecule binder to Keap1 and selective activator of Nrf2 signalling.
Method: X-RAY DIFFRACTION / Resolution: 3.36 Å

Chemicals

ChemComp-SO4:
SULFATE ION

ChemComp-51M:
(3S)-1-(4-{[(2,3,5,6-tetramethylphenyl)sulfonyl]amino}naphthalen-1-yl)pyrrolidine-3-carboxylic acid

ChemComp-HOH:
WATER

Source
  • mus musculus (house mouse)
KeywordsPROTEIN BINDING / BETA PROPELLER / Inhibitor / Complex

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