4TQN

Crystal structure of the bromodomain of human CREBBP in complex with UL04

Summary for 4TQN

Entry DOI	10.2210/pdb4tqn/pdb
Descriptor	CREB-binding protein, 3-[(5-acetyl-2-ethoxyphenyl)carbamoyl]benzoic acid, 1,2-ETHANEDIOL, ... (4 entities in total)
Functional Keywords	transcription/inhibitor, transferase
Biological source	Homo sapiens (Human)
Cellular location	Cytoplasm: Q92793
Total number of polymer chains	1
Total formula weight	14736.88
Authors	Dong, J.,Caflisch, A. (deposition date: 2014-06-11, release date: 2015-06-24, Last modification date: 2023-12-20)
Primary citation	Xu, M.,Unzue, A.,Dong, J.,Spiliotopoulos, D.,Nevado, C.,Caflisch, A. Discovery of CREBBP Bromodomain Inhibitors by High-Throughput Docking and Hit Optimization Guided by Molecular Dynamics. J.Med.Chem., 59:1340-1349, 2016 Cited by PubMed: 26125948 DOI: 10.1021/acs.jmedchem.5b00171 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.7 Å)

Structure validation