8B5G
C-TERMINAL BROMODOMAIN OF HUMAN BRD2 WITH 7,8-dimethoxy-3-methyl-1,3-dihydro-2H-benzo[d]azepin-2-one
This is a non-PDB format compatible entry.
Summary for 8B5G
Entry DOI | 10.2210/pdb8b5g/pdb |
Descriptor | Bromodomain-containing protein 2, 1,2-ETHANEDIOL, 7,8-dimethoxy-3-methyl-1~{H}-3-benzazepin-2-one, ... (5 entities in total) |
Functional Keywords | inhibitor complex bromodomain, transcription |
Biological source | Homo sapiens (human) |
Total number of polymer chains | 1 |
Total formula weight | 13985.10 |
Authors | Chung, C. (deposition date: 2022-09-22, release date: 2022-11-30, Last modification date: 2024-05-01) |
Primary citation | Humphreys, P.G.,Anderson, N.A.,Bamborough, P.,Baxter, A.,Chung, C.W.,Cookson, R.,Craggs, P.D.,Dalton, T.,Fournier, J.C.L.,Gordon, L.J.,Gray, H.F.,Gray, M.W.,Gregory, R.,Hirst, D.J.,Jamieson, C.,Jones, K.L.,Kessedjian, H.,Lugo, D.,McGonagle, G.,Patel, V.K.,Patten, C.,Poole, D.L.,Prinjha, R.K.,Ramirez-Molina, C.,Rioja, I.,Seal, G.,Stafford, K.A.J.,Shah, R.R.,Tape, D.,Theodoulou, N.H.,Tomlinson, L.,Ukuser, S.,Wall, I.D.,Wellaway, N.,White, G. Identification and Optimization of a Ligand-Efficient Benzoazepinone Bromodomain and Extra Terminal (BET) Family Acetyl-Lysine Mimetic into the Oral Candidate Quality Molecule I-BET432. J.Med.Chem., 65:15174-15207, 2022 Cited by PubMed: 36378954DOI: 10.1021/acs.jmedchem.2c01102 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.619 Å) |
Structure validation
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