5EK9
Crystal structure of the second bromodomain of human BRD2 in complex with a tetrahydroquinoline inhibitor
Summary for 5EK9
Entry DOI | 10.2210/pdb5ek9/pdb |
Descriptor | Bromodomain-containing protein 2, propan-2-yl ~{N}-[(2~{S},4~{R})-1-ethanoyl-6-(furan-2-yl)-2-methyl-3,4-dihydro-2~{H}-quinolin-4-yl]carbamate (3 entities in total) |
Functional Keywords | chromatin and transcription regulator, acetylation, structural genomics, structural genomics consortium, sgc, transcription |
Biological source | Homo sapiens (Human) |
Cellular location | Nucleus : P25440 |
Total number of polymer chains | 2 |
Total formula weight | 27463.65 |
Authors | Tallant, C.,Slavish, P.J.,Siejka, P.,Bharatham, N.,Shadrick, W.R.,Chai, S.,Young, B.M.,Boyd, V.A.,Heroven, C.,Picaud, S.,Fedorov, O.,Chen, T.,Lee, R.E.,Guy, R.K.,Shelat, A.A.,von Delft, F.,Arrowsmith, C.H.,Edwards, A.M.,Bountra, C.,Knapp, S.,Structural Genomics Consortium (SGC) (deposition date: 2015-11-03, release date: 2016-11-16, Last modification date: 2024-05-08) |
Primary citation | Shadrick, W.R.,Slavish, P.J.,Chai, S.C.,Waddell, B.,Connelly, M.,Low, J.A.,Tallant, C.,Young, B.M.,Bharatham, N.,Knapp, S.,Boyd, V.A.,Morfouace, M.,Roussel, M.F.,Chen, T.,Lee, R.E.,Kiplin Guy, R.,Shelat, A.A.,Potter, P.M. Exploiting a water network to achieve enthalpy-driven, bromodomain-selective BET inhibitors. Bioorg. Med. Chem., 26:25-36, 2018 Cited by PubMed: 29170024DOI: 10.1016/j.bmc.2017.10.042 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.08 Å) |
Structure validation
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