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TitleInsights into the crystal structure of BRD2-BD2 - phenanthridinone complex and theoretical studies on phenanthridinone analogs.
Journal, issue, pagesJ. Biomol. Struct. Dyn., Vol. 36, Page 2342-2360, Year 2018
Publish dateApr 20, 2017 (structure data deposition date)
AuthorsMathur, S. / Deshmukh, P. / Tripathi, S. / Marimuthu, P. / Padmanabhan, B.
External linksJ. Biomol. Struct. Dyn. / PubMed:28696179
MethodsX-ray diffraction
Resolution1.28 - 1.4 Å
Structure data

PDB-5xhe:
Crystal structure analysis of the second bromodomain of BRD2 covalently linked to b-mercaptoethanol
Method: X-RAY DIFFRACTION / Resolution: 1.4 Å

PDB-5xhk:
Crystal structure of the BRD2-BD2 in complex with phenanthridinone
Method: X-RAY DIFFRACTION / Resolution: 1.28 Å

Chemicals

ChemComp-PGE:
TRIETHYLENE GLYCOL

ChemComp-GOL:
GLYCEROL

ChemComp-HOH:
WATER

ChemComp-2ME:
METHOXYETHANE

ChemComp-LDR:
phenanthridin-6(5H)-one

Source
  • homo sapiens (human)
KeywordsTRANSCRIPTION / BET family / BRD2 / bromodomain / b-mercaptoethanol / CME / Phenanthridinone

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