5MME

Crystal structure of CREBBP bromodomain complexd with US46C

Summary for 5MME

DescriptorCREB-binding protein, dimethyl 5-[(5-ethanoyl-2-ethoxy-phenyl)amino]benzene-1,3-dicarboxylate (3 entities in total)
Functional Keywordsinhibitor, bromodomain, transferase
Biological sourceHomo sapiens (Human)
Total number of polymer chains2
Total molecular weight29189.47
Authors
Zhu, J.,Caflisch, A. (deposition date: 2016-12-09, release date: 2017-12-20, Last modification date: 2018-10-10)
Primary citation
Zhu, J.,Dong, J.,Batiste, L.,Unzue, A.,Dolbois, A.,Pascanu, V.,Sledz, P.,Nevado, C.,Caflisch, A.
Binding Motifs in the CBP Bromodomain: An Analysis of 20 Crystal Structures of Complexes with Small Molecules.
ACS Med Chem Lett, 9:929-934, 2018
PubMed: 30258543 (PDB entries with the same primary citation)
DOI: 10.1021/acsmedchemlett.8b00286
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.35 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers 0.176200 1.3%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution