Chlorine in PDB 7rn2: Crystal Structure of the First Bromodomain of Human BRD4 in Complex with SJ001010551-2

Protein crystallography data

The structure of Crystal Structure of the First Bromodomain of Human BRD4 in Complex with SJ001010551-2, PDB code: 7rn2 was solved by T.R.Stachowski, M.Fischer, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 33.07 / 1.05
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 36.477, 44.626, 78.416, 90, 90, 90
R / Rfree (%) 16.4 / 18.4

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with SJ001010551-2 (pdb code 7rn2). 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 Human BRD4 in Complex with SJ001010551-2, PDB code: 7rn2:

Chlorine binding site 1 out of 1 in 7rn2

Go back to Chlorine Binding Sites List in 7rn2
Chlorine binding site 1 out of 1 in the Crystal Structure of the First Bromodomain of Human BRD4 in Complex with SJ001010551-2


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 Human BRD4 in Complex with SJ001010551-2 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl202

b:16.9
occ:0.93
CL1 A:5ZQ202 0.0 16.9 0.9
C10 A:5ZQ202 1.8 14.6 0.9
C11 A:5ZQ202 2.7 16.7 0.9
C9 A:5ZQ202 2.7 14.2 0.9
H8 A:5ZQ202 2.8 17.1 0.9
H9 A:5ZQ202 2.8 20.0 0.9
HB3 A:ASP145 2.9 20.7 1.0
HB2 A:ASP145 3.5 20.7 1.0
CB A:ASP145 3.6 17.2 1.0
SD A:MET149 3.7 14.4 1.0
HZ2 A:TRP81 3.8 18.1 1.0
OD2 A:ASP145 3.9 19.0 1.0
C8 A:5ZQ202 4.0 12.8 0.9
C12 A:5ZQ202 4.1 16.0 0.9
CG A:ASP145 4.1 18.9 1.0
HE1 A:MET149 4.3 18.5 1.0
HH2 A:TRP81 4.5 18.8 1.0
C7 A:5ZQ202 4.5 13.2 0.9
CZ2 A:TRP81 4.6 15.1 1.0
CE A:MET149 4.6 15.4 1.0
O A:HOH377 4.6 31.5 1.0
H7 A:5ZQ202 4.7 15.4 0.9
HE3 A:MET149 4.8 18.5 1.0
H10 A:5ZQ202 4.8 19.2 0.9
CA A:ASP145 4.9 15.8 1.0
C A:ASP145 4.9 14.3 1.0
CH2 A:TRP81 4.9 15.6 1.0
HA A:ILE146 5.0 16.6 1.0

Reference:

T.R.Stachowski, M.Fischer. Crystal Structure of the First Bromodomain of Human BRD4 in Complex with SJ001011461-1 To Be Published.
Page generated: Tue Apr 4 21:36:53 2023

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