7WJS
Crystal Structure of the first bromodomain of human BRD4 in complex with the inhibitor Y13157
Summary for 7WJS
Entry DOI | 10.2210/pdb7wjs/pdb |
Descriptor | Bromodomain-containing protein 4, 2-(2-cyclobutyl-1~{H}-imidazol-5-yl)-7-[2-(4-fluoranyl-2,6-dimethyl-phenoxy)-5-(2-oxidanylpropan-2-yl)phenyl]-5-methyl-furo[3,2-c]pyridin-4-one, GLYCEROL, ... (4 entities in total) |
Functional Keywords | brd4, bromodomain, inhibitor, protein binding |
Biological source | Homo sapiens (human) |
Total number of polymer chains | 3 |
Total formula weight | 52755.66 |
Authors | |
Primary citation | Li, J.,Zhang, C.,Xu, H.,Wang, C.,Dong, R.,Shen, H.,Zhuang, X.,Chen, X.,Li, Q.,Lu, J.,Zhang, M.,Wu, X.,Loomes, K.M.,Zhou, Y.,Zhang, Y.,Liu, J.,Xu, Y. Structure-Based Discovery and Optimization of Furo[3,2- c ]pyridin-4(5 H )-one Derivatives as Potent and Second Bromodomain (BD2)-Selective Bromo and Extra Terminal Domain (BET) Inhibitors. J.Med.Chem., 65:5760-5799, 2022 Cited by PubMed: 35333526DOI: 10.1021/acs.jmedchem.2c00100 PDB entries with the same primary citation |
Experimental method | X-RAY DIFFRACTION (2.73 Å) |
Structure validation
Download full validation report