6PRT
Crystal structure of BRD4 bromodomain 1 with N-methylpyrrolidin-2-one (NMP) derivative 10 (methyl [(3R)-1-methyl-5-oxopyrrolidin-3-yl]acetate)
Summary for 6PRT
| Entry DOI | 10.2210/pdb6prt/pdb |
| Descriptor | Bromodomain-containing protein 4, methyl [(3R)-1-methyl-5-oxopyrrolidin-3-yl]acetate (3 entities in total) |
| Functional Keywords | brd4 bd1, bromodomain, olinone, protein binding |
| Biological source | Homo sapiens (Human) |
| Total number of polymer chains | 1 |
| Total formula weight | 15139.38 |
| Authors | Ilyichova, O.V.,Scanlon, M.J. (deposition date: 2019-07-11, release date: 2019-11-27, Last modification date: 2023-10-11) |
| Primary citation | Hilton-Proctor, J.P.,Ilyichova, O.,Zheng, Z.,Jennings, I.G.,Johnstone, R.W.,Shortt, J.,Mountford, S.J.,Scanlon, M.J.,Thompson, P.E. Synthesis and elaboration of N-methylpyrrolidone as an acetamide fragment substitute in bromodomain inhibition. Bioorg.Med.Chem., 27:115157-115157, 2019 Cited by PubMed: 31727451DOI: 10.1016/j.bmc.2019.115157 PDB entries with the same primary citation |
| Experimental method | X-RAY DIFFRACTION (1.3 Å) |
Structure validation
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