Chlorine in PDB 7ugf: First Bromodomain of BRD4 Liganded with Bms-536924

The structure of First Bromodomain of BRD4 Liganded with Bms-536924, PDB code: 7ugf was solved by E.Schonbrunn, M.Bikowitz, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	39.32 / 1.45
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	37.4, 44.26, 78.64, 90, 90, 90
R / Rfree (%)	17.1 / 19

The binding sites of Chlorine atom in the First Bromodomain of BRD4 Liganded with Bms-536924 (pdb code 7ugf). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the First Bromodomain of BRD4 Liganded with Bms-536924, PDB code: 7ugf:

Chlorine binding site 1 out of 1 in the First Bromodomain of BRD4 Liganded with Bms-536924


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of First Bromodomain of BRD4 Liganded with Bms-536924 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:33.5 occ:1.00 CL16 A:N6I201 0.0 33.5 1.0 C15 A:N6I201 1.8 28.0 1.0 C17 A:N6I201 2.7 28.2 1.0 C14 A:N6I201 2.8 33.7 1.0 SD A:MET149 3.2 15.8 1.0 CD1 A:ILE146 4.0 19.9 1.0 CH2 A:TRP81 4.0 18.1 1.0 C11 A:N6I201 4.0 29.8 1.0 C13 A:N6I201 4.0 35.1 1.0 CE A:MET149 4.1 13.6 1.0 CZ2 A:TRP81 4.1 18.8 1.0 CB A:ASP145 4.2 19.8 1.0 N A:ILE146 4.2 14.5 1.0 CA A:ILE146 4.3 14.7 1.0 CG A:PRO82 4.3 12.6 1.0 CB A:ILE146 4.3 14.6 1.0 C12 A:N6I201 4.5 32.2 1.0 C A:ASP145 4.6 17.1 1.0 O A:HOH397 4.6 21.8 1.0 CG1 A:ILE146 4.8 17.6 1.0 CZ3 A:TRP81 4.9 18.2 1.0 CG A:MET149 4.9 10.8 1.0 O A:ASP145 5.0 16.2 1.0

E.Schonbrunn, M.Bikowitz. Structural Basis of Cbp and EP300 Interaction with Kinase Inhibitors To Be Published.