Chlorine in PDB 6s25: Crystal Structure of the First Bromodomain of BRD4 in Complex with A Benzodiazepine Ligand

The structure of Crystal Structure of the First Bromodomain of BRD4 in Complex with A Benzodiazepine Ligand, PDB code: 6s25 was solved by S.Picaud, R.Traquete, G.J.L.Bernardes, K.Tobias, F.Von Delft, C.H.Arrowsmith, A.M.Edwards, C.Bountra, P.Filippakopoulos, Structuralgenomics Consortium (Sgc), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	28.50 / 1.10
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	37.247, 44.228, 78.512, 90.00, 90.00, 90.00
R / Rfree (%)	12.4 / 14.5

The binding sites of Chlorine atom in the Crystal Structure of the First Bromodomain of BRD4 in Complex with A Benzodiazepine Ligand (pdb code 6s25). 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 Crystal Structure of the First Bromodomain of BRD4 in Complex with A Benzodiazepine Ligand, PDB code: 6s25:

Chlorine binding site 1 out of 1 in the Crystal Structure of the First Bromodomain of BRD4 in Complex with A Benzodiazepine Ligand


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of the First Bromodomain of BRD4 in Complex with A Benzodiazepine Ligand within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl204 b:10.4 occ:1.00 CL1 A:KSZ204 0.0 10.4 1.0 C16 A:KSZ204 1.6 7.8 1.0 C15 A:KSZ204 2.6 8.4 1.0 C17 A:KSZ204 2.7 8.6 1.0 CB A:ASP145 3.6 8.9 1.0 SD A:MET149 3.9 10.4 1.0 OD2 A:ASP145 3.9 11.9 1.0 C2 A:EDO203 4.0 18.9 1.0 C14 A:KSZ204 4.0 7.2 1.0 C18 A:KSZ204 4.0 8.3 1.0 CG A:ASP145 4.1 10.6 1.0 O A:HOH377 4.4 24.2 1.0 C13 A:KSZ204 4.5 6.3 1.0 C1 A:EDO203 4.6 18.6 1.0 CZ2 A:TRP81 4.6 7.9 1.0 CE A:MET149 4.7 11.0 1.0 CH2 A:TRP81 4.9 7.8 1.0 CA A:ASP145 4.9 7.9 1.0 C A:ASP145 4.9 7.3 1.0

S.Picaud, R.Traquete, G.J.L.Bernardes, K.Tobias, F.Von Delft, C.H.Arrowsmith, A.M.Edwards, C.Bountra, P.Filippakopoulos, Structural Genomics Consortium (Sgc). Crystal Structure of the First Bromodomain of BRD4 in Complex with A Benzodiazepine Ligand To Be Published.