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Structure paper

TitleNovel pyrano 1,3 oxazine based ligand inhibits the epigenetic reader hBRD2 in glioblastoma.
Journal, issue, pagesBiochem. J., Vol. 477, Page 2263-2279, Year 2020
Publish dateFeb 28, 2019 (structure data deposition date)
AuthorsDeshmukh, P. / Mathur, S. / Gangadharan, G. / Krishnappa, G. / Dalavaikodihalli Nanjaiah, N. / Padmanabhan, B.
External linksBiochem. J. / PubMed:32484211
MethodsX-ray diffraction
Resolution1.5 Å
Structure data

PDB-6jke:
Discovery and the crystal structure of NS5 in complex with the N-terminal bromodomain of BRD2.
Method: X-RAY DIFFRACTION / Resolution: 1.5 Å

Chemicals

ChemComp-BUX:
7-chloranyl-2-[(3-chlorophenyl)amino]pyrano[3,4-e][1,3]oxazine-4,5-dione

ChemComp-SO4:
SULFATE ION

ChemComp-DTT:
2,3-DIHYDROXY-1,4-DITHIOBUTANE

ChemComp-GOL:
GLYCEROL

ChemComp-DMS:
DIMETHYL SULFOXIDE / DMSO, precipitant*YM

ChemComp-PGE:
TRIETHYLENE GLYCOL

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSCRIPTION / BET family / BET inhibitor / Bromodomain Inhibitor / BRD2-BD1 inhibitor

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