5XXH

Crystal Structure Analysis of the CBP

Summary for 5XXH

DescriptorCREB-binding protein, (3S)-1-[2-(3-ethanoylindol-1-yl)ethanoyl]piperidine-3-carboxylic acid, 1,2-ETHANEDIOL, ... (5 entities in total)
Functional Keywordscbp, bromodomain, transferase
Biological sourceHomo sapiens (Human)
Total number of polymer chains1
Total molecular weight16306.03
Authors
Xiang, Q.,Zhang, Y.,Wang, C.,Song, M. (deposition date: 2017-07-04, release date: 2018-06-13)
Primary citation
Xiang, Q.,Wang, C.,Zhang, Y.,Xue, X.,Song, M.,Zhang, C.,Li, C.,Wu, C.,Li, K.,Hui, X.,Zhou, Y.,Smaill, J.B.,Patterson, A.V.,Wu, D.,Ding, K.,Xu, Y.
Discovery and optimization of 1-(1H-indol-1-yl)ethanone derivatives as CBP/EP300 bromodomain inhibitors for the treatment of castration-resistant prostate cancer.
Eur J Med Chem, 147:238-252, 2018
PubMed: 29448139 (PDB entries with the same primary citation)
DOI: 10.1016/j.ejmech.2018.01.087
MImport into Mendeley
Experimental method
X-RAY DIFFRACTION (1.62 Å)
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Structure validation

RfreeClashscoreRamachandran outliersSidechain outliersRSRZ outliers0.217101.9%2.6%MetricValuePercentile RanksWorseBetterPercentile relative to all X-ray structuresPercentile relative to X-ray structures of similar resolution
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