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5WUU

Complex structure of the first bromodomain of BRD4 with an inhibitor that containing a 2H-chromen-2-one ring

Summary for 5WUU
Entry DOI10.2210/pdb5wuu/pdb
DescriptorBromodomain-containing protein 4, ~{N}-methyl-~{N}-[3-[(2-oxidanylidenechromen-4-yl)amino]propyl]thiophene-2-carboxamide (3 entities in total)
Functional Keywordsbrd4, inhibitor, complex, transcription
Biological sourceHomo sapiens (Human)
Cellular locationNucleus: O60885
Total number of polymer chains1
Total formula weight17037.59
Authors
Zhang, H.,Sun, Z.Y. (deposition date: 2016-12-21, release date: 2017-04-12, Last modification date: 2023-11-22)
Primary citationSun, Z.,Zhang, H.,Chen, Z.,Xie, Y.,Jiang, H.,Chen, L.,Ding, H.,Zhang, Y.,Jiang, H.,Zheng, M.,Luo, C.
Discovery of novel BRD4 inhibitors by high-throughput screening, crystallography, and cell-based assays.
Bioorg. Med. Chem. Lett., 27:2003-2009, 2017
Cited by
PubMed: 28347667
DOI: 10.1016/j.bmcl.2017.03.012
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.724 Å)
Structure validation

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