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Chlorine in PDB 3lhe: The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne

Protein crystallography data

The structure of The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne, PDB code: 3lhe was solved by K.Tan, G.Chhor, S.Clancy, A.Joachimiak, Midwest Center Forstructural Genomics (Mcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 26.10 / 1.62
Space group C 2 2 21
Cell size a, b, c (Å), α, β, γ (°) 39.595, 76.003, 107.738, 90.00, 90.00, 90.00
R / Rfree (%) 18.9 / 22.8

Chlorine Binding Sites:

The binding sites of Chlorine atom in the The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne (pdb code 3lhe). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne, PDB code: 3lhe:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 3lhe

Go back to Chlorine Binding Sites List in 3lhe
Chlorine binding site 1 out of 2 in the The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl233

b:45.4
occ:1.00
O A:PHE125 2.8 22.2 1.0
O A:HOH64 2.9 42.5 1.0
OG A:SER150 3.3 48.7 1.0
N A:SER150 3.3 26.6 1.0
N A:ILE149 3.4 17.8 1.0
CB A:SER150 3.5 41.2 1.0
CG1 A:ILE149 3.7 21.2 1.0
CB A:PRO148 3.8 23.9 1.0
O A:HOH24 3.8 32.0 1.0
C A:PRO148 3.9 23.5 1.0
CA A:PRO148 3.9 17.9 1.0
C A:PHE125 3.9 19.7 1.0
CA A:SER150 4.0 35.6 1.0
N A:PHE125 4.1 20.3 1.0
CA A:ILE149 4.2 21.1 1.0
C A:ILE149 4.2 24.6 1.0
CA A:PHE125 4.4 17.7 1.0
CB A:ILE149 4.5 21.9 1.0
CB A:PHE125 4.7 17.3 1.0
CB A:ASP124 4.8 25.8 1.0
O A:PRO148 4.8 23.7 1.0
C A:ASP124 4.9 23.1 1.0
CD1 A:ILE149 4.9 23.9 1.0

Chlorine binding site 2 out of 2 in 3lhe

Go back to Chlorine Binding Sites List in 3lhe
Chlorine binding site 2 out of 2 in the The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl234

b:54.8
occ:1.00
O A:HOH59 2.6 32.1 1.0
N A:SER137 3.0 25.6 1.0
OE2 A:GLU99 3.4 39.0 1.0
N A:HIS136 3.5 26.1 1.0
CA A:HIS136 3.6 27.7 1.0
C A:HIS136 3.7 23.4 1.0
O A:HOH235 3.8 30.0 1.0
CA A:SER137 3.8 29.4 1.0
O A:ILE134 4.2 27.6 1.0
CG2 A:ILE134 4.2 25.3 1.0
C A:ILE135 4.3 25.4 1.0
CD A:GLU99 4.3 42.5 1.0
CG A:GLU99 4.4 38.8 1.0
OG A:SER137 4.4 33.0 1.0
CB A:GLU99 4.6 29.8 1.0
C A:ILE134 4.6 22.2 1.0
CG2 A:VAL98 4.7 35.1 1.0
CB A:SER137 4.8 28.8 1.0
N A:GLU99 4.8 32.0 1.0
CA A:ILE135 4.8 22.3 1.0
N A:VAL98 4.9 34.5 1.0
N A:ILE135 4.9 21.1 1.0
O A:HIS136 4.9 27.2 1.0
C A:SER137 5.0 28.0 1.0

Reference:

K.Tan, G.Chhor, S.Clancy, A.Joachimiak. The Crystal Structure of the C-Terminal Domain of A Gntr Family Transcriptional Regulator From Bacillus Anthracis Str. Sterne To Be Published.
Page generated: Sat Jul 20 23:27:30 2024

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