Chlorine in PDB 7rv3: Crystal Structure of the BCL6 Btb Domain in Complex with Oicr-9124
Protein crystallography data
The structure of Crystal Structure of the BCL6 Btb Domain in Complex with Oicr-9124, PDB code: 7rv3
was solved by
D.A.Kuntz,
G.G.Prive,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
36.15 /
1.35
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
30.452,
72.292,
55.154,
90,
105.26,
90
|
R / Rfree (%)
|
15.9 /
18.6
|
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Crystal Structure of the BCL6 Btb Domain in Complex with Oicr-9124
(pdb code 7rv3). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the
Crystal Structure of the BCL6 Btb Domain in Complex with Oicr-9124, PDB code: 7rv3:
Jump to Chlorine binding site number:
1;
2;
Chlorine binding site 1 out
of 2 in 7rv3
Go back to
Chlorine Binding Sites List in 7rv3
Chlorine binding site 1 out
of 2 in the Crystal Structure of the BCL6 Btb Domain in Complex with Oicr-9124
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 BCL6 Btb Domain in Complex with Oicr-9124 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl201
b:8.9
occ:0.82
|
CL10
|
A:7R5201
|
0.0
|
8.9
|
0.8
|
C09
|
A:7R5201
|
1.7
|
9.7
|
0.8
|
H031
|
A:7R5201
|
2.6
|
10.3
|
0.8
|
C04
|
A:7R5201
|
2.7
|
9.4
|
0.8
|
C08
|
A:7R5201
|
2.7
|
11.1
|
0.8
|
HA
|
A:ALA52
|
2.9
|
10.6
|
1.0
|
H081
|
A:7R5201
|
2.9
|
13.3
|
0.8
|
N03
|
A:7R5201
|
3.0
|
8.6
|
0.8
|
HD1
|
A:TYR58
|
3.0
|
14.1
|
1.0
|
HB3
|
A:MET51
|
3.2
|
10.6
|
1.0
|
O
|
A:MET51
|
3.3
|
10.1
|
1.0
|
C
|
A:MET51
|
3.5
|
9.0
|
1.0
|
N
|
A:ALA52
|
3.6
|
8.7
|
1.0
|
CA
|
A:ALA52
|
3.6
|
8.8
|
1.0
|
HB2
|
A:MET51
|
3.8
|
10.6
|
1.0
|
CD1
|
A:TYR58
|
3.8
|
11.8
|
1.0
|
HE1
|
A:TYR58
|
3.8
|
15.2
|
1.0
|
CB
|
A:MET51
|
3.9
|
8.8
|
1.0
|
N07
|
A:7R5201
|
4.0
|
11.2
|
0.8
|
C05
|
A:7R5201
|
4.0
|
10.7
|
0.8
|
H
|
A:ALA52
|
4.1
|
10.4
|
1.0
|
HE2
|
A:MET51
|
4.1
|
20.6
|
1.0
|
HB2
|
A:ALA52
|
4.1
|
11.0
|
1.0
|
CE1
|
A:TYR58
|
4.2
|
12.7
|
1.0
|
C02
|
A:7R5201
|
4.3
|
9.6
|
0.8
|
CA
|
A:MET51
|
4.4
|
8.6
|
1.0
|
CB
|
A:ALA52
|
4.5
|
9.2
|
1.0
|
C06
|
A:7R5201
|
4.5
|
11.0
|
0.8
|
HB2
|
A:TYR58
|
4.5
|
11.0
|
1.0
|
H111
|
A:7R5201
|
4.6
|
12.2
|
0.8
|
C
|
A:ALA52
|
4.8
|
9.5
|
1.0
|
HB1
|
A:ALA52
|
4.8
|
11.0
|
1.0
|
H051
|
A:7R5201
|
4.8
|
12.9
|
0.8
|
HA
|
A:MET51
|
4.8
|
10.3
|
1.0
|
CG
|
A:TYR58
|
4.9
|
10.5
|
1.0
|
C11
|
A:7R5201
|
5.0
|
10.2
|
0.8
|
O
|
A:THR48
|
5.0
|
8.8
|
1.0
|
|
Chlorine binding site 2 out
of 2 in 7rv3
Go back to
Chlorine Binding Sites List in 7rv3
Chlorine binding site 2 out
of 2 in the Crystal Structure of the BCL6 Btb Domain in Complex with Oicr-9124
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Crystal Structure of the BCL6 Btb Domain in Complex with Oicr-9124 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl204
b:33.0
occ:1.00
|
H
|
A:LEU31
|
2.1
|
11.4
|
1.0
|
O
|
A:HOH379
|
2.8
|
38.4
|
1.0
|
N
|
A:LEU31
|
3.0
|
9.5
|
1.0
|
HA
|
A:ILE30
|
3.1
|
11.7
|
1.0
|
HA
|
A:LEU31
|
3.2
|
11.9
|
1.0
|
HD23
|
A:LEU31
|
3.5
|
18.4
|
1.0
|
O
|
A:HOH363
|
3.6
|
36.5
|
1.0
|
CA
|
A:LEU31
|
3.6
|
9.9
|
1.0
|
O
|
A:ASP29
|
3.8
|
15.2
|
1.0
|
C
|
A:ILE30
|
4.0
|
8.9
|
1.0
|
HG
|
A:LEU31
|
4.0
|
17.4
|
1.0
|
CA
|
A:ILE30
|
4.0
|
9.7
|
1.0
|
HG23
|
A:ILE30
|
4.0
|
11.2
|
1.0
|
CD2
|
A:LEU31
|
4.3
|
15.3
|
1.0
|
H
|
A:THR32
|
4.4
|
11.3
|
1.0
|
CG
|
A:LEU31
|
4.5
|
14.5
|
1.0
|
O
|
A:HOH349
|
4.5
|
40.6
|
1.0
|
HD21
|
A:LEU31
|
4.6
|
18.4
|
1.0
|
C
|
A:LEU31
|
4.6
|
9.3
|
1.0
|
CB
|
A:LEU31
|
4.7
|
11.2
|
1.0
|
O
|
A:HOH369
|
4.7
|
33.3
|
1.0
|
CG2
|
A:ILE30
|
4.7
|
9.3
|
1.0
|
C
|
A:ASP29
|
4.7
|
11.9
|
1.0
|
N
|
A:THR32
|
4.8
|
9.4
|
1.0
|
HG12
|
A:ILE30
|
4.8
|
13.7
|
1.0
|
HG22
|
A:ILE30
|
4.8
|
11.2
|
1.0
|
N
|
A:ILE30
|
4.9
|
9.3
|
1.0
|
CB
|
A:ILE30
|
4.9
|
9.9
|
1.0
|
|
Reference:
I.Watson,
M.Isaac.
Structure of the BCL6 Btb Domain To Be Published.
Page generated: Tue Apr 4 21:39:09 2023
|