7AQT
NMR2 structure of BRD4-BD2 in complex with iBET-762
Summary for 7AQT
| Entry DOI | 10.2210/pdb7aqt/pdb |
| NMR Information | BMRB: 34566 |
| Descriptor | Bromodomain-containing protein 4, 2-[(4S)-6-(4-chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]-N-ethylacetamide (2 entities in total) |
| Functional Keywords | brd4, bd2, bromodomain, ibet-762, nmr2, oncoprotein |
| Biological source | Homo sapiens (Human) |
| Total number of polymer chains | 1 |
| Total formula weight | 13173.69 |
| Authors | Orts, J.,Torres, F.,Milbradt, A.G.,Walser, R. (deposition date: 2020-10-23, release date: 2022-03-02, Last modification date: 2022-04-27) |
| Primary citation | Torres, F.,Walser, R.,Kaderli, J.,Rossi, E.,Bobby, R.,Packer, M.J.,Sarda, S.,Walker, G.,Hitchin, J.R.,Milbradt, A.G.,Orts, J. NMR Molecular Replacement Provides New Insights into Binding Modes to Bromodomains of BRD4 and TRIM24. J.Med.Chem., 65:5565-5574, 2022 Cited by PubMed: 35357834DOI: 10.1021/acs.jmedchem.1c01703 PDB entries with the same primary citation |
| Experimental method | SOLUTION NMR |
Structure validation
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