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5MQE

Crystal structure of CREBBP bromodomain complexed with CBP006

Summary for 5MQE
Entry DOI10.2210/pdb5mqe/pdb
DescriptorCREB-binding protein, 4-bromanyl-~{N}-methyl-1~{H}-pyrrole-2-carboxamide (3 entities in total)
Functional Keywordscrebbp bromodomain, inhibitor, transcription
Biological sourceHomo sapiens (Human)
Total number of polymer chains2
Total formula weight28852.77
Authors
Zhu, J.,Spiliotopoulos, D.,Caflisch, A. (deposition date: 2016-12-20, release date: 2017-04-19, Last modification date: 2019-10-16)
Primary citationSpiliotopoulos, D.,Zhu, J.,Wamhoff, E.C.,Deerain, N.,Marchand, J.R.,Aretz, J.,Rademacher, C.,Caflisch, A.
Virtual screen to NMR (VS2NMR): Discovery of fragment hits for the CBP bromodomain.
Bioorg. Med. Chem. Lett., 27:2472-2478, 2017
Cited by
PubMed: 28410781
DOI: 10.1016/j.bmcl.2017.04.001
PDB entries with the same primary citation
Experimental method
X-RAY DIFFRACTION (1.65 Å)
Structure validation

217705

數據於2024-03-27公開中

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