5M3A

Crystal structure of BRD4 BROMODOMAIN 1 IN COMPLEX WITH LIGAND 2

Summary for 5M3A

Entry DOI	10.2210/pdb5m3a/pdb
Descriptor	Bromodomain-containing protein 4, 1,2-ETHANEDIOL, 3-methyl-6-(1-methyl-5-phenoxy-pyrazol-4-yl)-[1,2,4]triazolo[4,3-b]pyridazine, ... (4 entities in total)
Functional Keywords	bromodomain, brd4 bd1, epigenetic, histone reader, transcription
Biological source	Homo sapiens (Human)
Cellular location	Nucleus: O60885
Total number of polymer chains	1
Total formula weight	15529.84
Authors	Kessler, D.,Mayer, M.,Engelhardt, H.,Wolkerstorfer, B.,Geist, L. (deposition date: 2016-10-14, release date: 2017-09-27, Last modification date: 2024-01-17)
Primary citation	Geist, L.,Mayer, M.,Cockcroft, X.L.,Wolkerstorfer, B.,Kessler, D.,Engelhardt, H.,McConnell, D.B.,Konrat, R. Direct NMR Probing of Hydration Shells of Protein Ligand Interfaces and Its Application to Drug Design. J. Med. Chem., 60:8708-8715, 2017 Cited by PubMed: 28910100 DOI: 10.1021/acs.jmedchem.7b00845 PDB entries with the same primary citation
Experimental method	X-RAY DIFFRACTION (1.65 Å)

Structure validation