7KHL
BRD4-BD1 Compound6 (methyl 4-(3,5-difluoropyridin-2-yl)-10-methyl-7-((methylsulfonyl)methyl)-11-oxo-3,4,10,11-tetrahydro-1H-1,4,10-triazadibenzo[cd,f]azulene-6-carboxylate)
Summary for 7KHL
Entry DOI | 10.2210/pdb7khl/pdb |
Descriptor | Bromodomain-containing protein 4, methyl 7-(3,5-difluoropyridin-2-yl)-2-methyl-10-[(methylsulfonyl)methyl]-3-oxo-3,4,6,7-tetrahydro-2H-2,4,7-triazadibenzo[cd,f]azulene-9-carboxylate, GLYCEROL, ... (4 entities in total) |
Functional Keywords | sbdd, cell cycle |
Biological source | Homo sapiens (Human) |
Total number of polymer chains | 2 |
Total formula weight | 35856.67 |
Authors | Murray, J.M. (deposition date: 2020-10-21, release date: 2021-02-24, Last modification date: 2023-10-18) |
Primary citation | Dragovich, P.S.,Pillow, T.H.,Blake, R.A.,Sadowsky, J.D.,Adaligil, E.,Adhikari, P.,Chen, J.,Corr, N.,Dela Cruz-Chuh, J.,Del Rosario, G.,Fullerton, A.,Hartman, S.J.,Jiang, F.,Kaufman, S.,Kleinheinz, T.,Kozak, K.R.,Liu, L.,Lu, Y.,Mulvihill, M.M.,Murray, J.M.,O'Donohue, A.,Rowntree, R.K.,Sawyer, W.S.,Staben, L.R.,Wai, J.,Wang, J.,Wei, B.,Wei, W.,Xu, Z.,Yao, H.,Yu, S.F.,Zhang, D.,Zhang, H.,Zhang, S.,Zhao, Y.,Zhou, H.,Zhu, X. Antibody-Mediated Delivery of Chimeric BRD4 Degraders. Part 2: Improvement of In Vitro Antiproliferation Activity and In Vivo Antitumor Efficacy. J.Med.Chem., 64:2576-2607, 2021 Cited by PubMed: 33596073DOI: 10.1021/acs.jmedchem.0c01846 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (1.286 Å) |
Structure validation
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