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Structure paper

TitleDiscovery and Molecular Basis of a Diverse Set of Polycomb Repressive Complex 2 Inhibitors Recognition by EED
Journal, issue, pagesPLoS ONE, Vol. 12, Page e0169855-e0169855, Year 2017
Publish dateOct 8, 2016 (structure data deposition date)
AuthorsLi, L. / Zhang, H. / Zhang, M. / Zhao, M. / Feng, L. / Luo, X. / Gao, Z. / Huang, Y. / Ardayfio, O. / Zhang, J.H. ...Li, L. / Zhang, H. / Zhang, M. / Zhao, M. / Feng, L. / Luo, X. / Gao, Z. / Huang, Y. / Ardayfio, O. / Zhang, J.H. / Lin, Y. / Fan, H. / Mi, Y. / Li, G. / Liu, L. / Luo, F. / Teng, L. / Qi, W. / Ottl, J. / Lingel, A. / Bussiere, D.E. / Yu, Z. / Atadja, P. / Lu, C. / Li, E. / Gu, J. / Zhao, K.
External linksPLoS ONE / PubMed:28072869
MethodsX-ray diffraction
Resolution1.9 - 2.3 Å
Structure data

PDB-5h13:
EED in complex with PRC2 allosteric inhibitor EED396
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-5h14:
EED in complex with an allosteric PRC2 inhibitor EED666
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

PDB-5h15:
EED in complex with PRC2 allosteric inhibitor EED709
Method: X-RAY DIFFRACTION / Resolution: 2.27 Å

PDB-5h17:
EED in complex with PRC2 allosteric inhibitor EED210
Method: X-RAY DIFFRACTION / Resolution: 2.3 Å

PDB-5h19:
EED in complex with PRC2 allosteric inhibitor EED162
Method: X-RAY DIFFRACTION / Resolution: 1.9 Å

Chemicals

ChemComp-GOL:
GLYCEROL

ChemComp-PR:
PRASEODYMIUM ION

ChemComp-LQA:
4-azanylidene-2-(3-methoxy-4-propan-2-yloxy-phenyl)-6,7-dihydro-[1,3]benzodioxolo[6,5-a]quinolizine-3-carbonitrile

ChemComp-HOH:
WATER

ChemComp-LQB:
2-[3-(3,5-dimethylpyrazol-1-yl)-4-nitro-phenyl]-3,4-dihydro-1H-isoquinoline

ChemComp-LQD:
(3R,4S)-1-[(2-methoxyphenyl)methyl]-N,N-dimethyl-4-(1-methylindol-3-yl)pyrrolidin-3-amine

ChemComp-LQE:
(3R,4aS,10aS)-6-methoxy-3-[(3-methoxyphenyl)methyl]-1-methyl-3,4,4a,5,10,10a-hexahydro-2H-benzo[g]quinoline

ChemComp-LQF:
5-(furan-2-ylmethylamino)-9-(phenylmethyl)-8,10-dihydro-7H-[1,2,4]triazolo[3,4-a][2,7]naphthyridine-6-carbonitrile

Source
  • homo sapiens (human)
KeywordsTransferase/Transferase Inhibitor / EED / PRC2 / inhibitor / Transferase-Transferase Inhibitor complex

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