5D3R
First bromodomain of BRD4 bound to inhibitor XD42
Summary for 5D3R
| Entry DOI | 10.2210/pdb5d3r/pdb |
| Descriptor | Bromodomain-containing protein 4, 4-acetyl-N-[3-(azepan-1-ylsulfonyl)phenyl]-5-methyl-3-propyl-1H-pyrrole-2-carboxamide (3 entities in total) |
| Functional Keywords | gene regulation, bromodomain, inhibitor, transcription |
| Biological source | Homo sapiens (Human) |
| Cellular location | Nucleus: O60885 |
| Total number of polymer chains | 1 |
| Total formula weight | 15544.95 |
| Authors | Wohlwend, D.,Huegle, M. (deposition date: 2015-08-06, release date: 2016-01-20, Last modification date: 2017-09-06) |
| Primary citation | Hugle, M.,Lucas, X.,Weitzel, G.,Ostrovskyi, D.,Breit, B.,Gerhardt, S.,Einsle, O.,Gunther, S.,Wohlwend, D. 4-Acyl Pyrrole Derivatives Yield Novel Vectors for Designing Inhibitors of the Acetyl-Lysine Recognition Site of BRD4(1). J.Med.Chem., 59:1518-1530, 2016 Cited by PubMed: 26731611DOI: 10.1021/acs.jmedchem.5b01267 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (2.2 Å) |
Structure validation
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