Chlorine in PDB 8vl8: Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
Protein crystallography data
The structure of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7, PDB code: 8vl8
was solved by
S.Glenn,
A.Baylink,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
61.50 /
2.50
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
126.022,
74.771,
128.931,
90,
116.14,
90
|
R / Rfree (%)
|
22.6 /
27.3
|
Other elements in 8vl8:
The structure of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7 also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
(pdb code 8vl8). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 7 binding sites of Chlorine where determined in the
Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7, PDB code: 8vl8:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
Chlorine binding site 1 out
of 7 in 8vl8
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Chlorine Binding Sites List in 8vl8
Chlorine binding site 1 out
of 7 in the Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl203
b:53.5
occ:1.00
|
O
|
B:HOH328
|
3.3
|
22.6
|
1.0
|
N
|
A:SER158
|
3.6
|
19.7
|
1.0
|
CB
|
A:GLN157
|
3.6
|
16.1
|
1.0
|
CB
|
A:PRO155
|
3.8
|
15.0
|
1.0
|
CA
|
A:PRO155
|
3.9
|
19.9
|
1.0
|
O
|
A:HOH328
|
4.1
|
18.7
|
1.0
|
CB
|
A:SER158
|
4.2
|
18.5
|
1.0
|
O
|
A:PRO155
|
4.2
|
27.9
|
1.0
|
C
|
A:GLN157
|
4.2
|
20.4
|
1.0
|
CA
|
A:GLN157
|
4.3
|
20.2
|
1.0
|
N
|
A:GLN157
|
4.3
|
15.0
|
1.0
|
C
|
A:PRO155
|
4.3
|
19.0
|
1.0
|
O
|
A:HOH324
|
4.3
|
31.0
|
1.0
|
CA
|
A:SER158
|
4.4
|
16.8
|
1.0
|
CG
|
A:GLN157
|
4.5
|
17.7
|
1.0
|
O
|
B:HOH332
|
4.6
|
24.3
|
1.0
|
OG
|
A:SER158
|
4.7
|
18.2
|
1.0
|
|
Chlorine binding site 2 out
of 7 in 8vl8
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Chlorine Binding Sites List in 8vl8
Chlorine binding site 2 out
of 7 in the Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl204
b:47.8
occ:1.00
|
N
|
A:ASN149
|
3.1
|
16.6
|
1.0
|
N
|
A:GLU150
|
3.1
|
16.7
|
1.0
|
C
|
A:LYS147
|
3.4
|
18.0
|
1.0
|
CB
|
A:ASN149
|
3.4
|
23.7
|
1.0
|
CA
|
A:LYS147
|
3.5
|
25.1
|
1.0
|
N
|
A:ILE148
|
3.6
|
17.9
|
1.0
|
CA
|
A:ASN149
|
3.6
|
22.7
|
1.0
|
O
|
A:LYS147
|
3.7
|
20.6
|
1.0
|
CB
|
A:GLU150
|
3.8
|
24.3
|
1.0
|
C
|
A:ASN149
|
3.9
|
29.5
|
1.0
|
CB
|
A:LYS147
|
3.9
|
24.3
|
1.0
|
C
|
A:ILE148
|
4.0
|
15.5
|
1.0
|
CA
|
A:GLU150
|
4.1
|
22.0
|
1.0
|
CG
|
A:LYS147
|
4.2
|
28.9
|
1.0
|
OD1
|
A:ASN149
|
4.2
|
23.8
|
1.0
|
CG
|
A:ASN149
|
4.3
|
19.2
|
1.0
|
CA
|
A:ILE148
|
4.4
|
22.6
|
1.0
|
OE1
|
A:GLU150
|
4.5
|
31.1
|
1.0
|
O
|
A:HOH326
|
4.7
|
26.6
|
1.0
|
CG2
|
A:ILE148
|
4.9
|
17.8
|
1.0
|
N
|
A:LYS147
|
4.9
|
30.4
|
1.0
|
N
|
A:PHE151
|
5.0
|
14.4
|
1.0
|
|
Chlorine binding site 3 out
of 7 in 8vl8
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Chlorine Binding Sites List in 8vl8
Chlorine binding site 3 out
of 7 in the Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl206
b:46.2
occ:1.00
|
N
|
B:ASN149
|
3.2
|
25.0
|
1.0
|
C
|
B:LYS147
|
3.3
|
23.5
|
1.0
|
N
|
B:ILE148
|
3.4
|
23.5
|
1.0
|
CA
|
B:LYS147
|
3.4
|
32.0
|
1.0
|
N
|
B:GLU150
|
3.6
|
25.8
|
1.0
|
CB
|
B:ASN149
|
3.6
|
31.4
|
1.0
|
O
|
B:LYS147
|
3.7
|
22.6
|
1.0
|
CA
|
B:ASN149
|
3.9
|
27.9
|
1.0
|
CB
|
B:LYS147
|
3.9
|
26.3
|
1.0
|
ND2
|
B:ASN149
|
3.9
|
34.3
|
1.0
|
CG
|
B:GLU150
|
4.1
|
33.6
|
1.0
|
CG
|
B:LYS147
|
4.2
|
29.5
|
1.0
|
C
|
B:ILE148
|
4.2
|
32.9
|
1.0
|
C
|
B:ASN149
|
4.2
|
27.1
|
1.0
|
CG
|
B:ASN149
|
4.3
|
38.1
|
1.0
|
CA
|
B:ILE148
|
4.4
|
21.9
|
1.0
|
CB
|
B:GLU150
|
4.4
|
26.4
|
1.0
|
CA
|
B:GLU150
|
4.6
|
26.6
|
1.0
|
O
|
B:GLY146
|
4.7
|
25.7
|
1.0
|
N
|
B:LYS147
|
4.7
|
32.6
|
1.0
|
CG2
|
B:ILE148
|
4.8
|
29.5
|
1.0
|
OE2
|
B:GLU150
|
4.9
|
54.8
|
1.0
|
|
Chlorine binding site 4 out
of 7 in 8vl8
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Chlorine Binding Sites List in 8vl8
Chlorine binding site 4 out
of 7 in the Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl207
b:48.8
occ:1.00
|
N
|
B:SER158
|
3.2
|
16.1
|
1.0
|
CB
|
B:PRO155
|
3.3
|
20.9
|
1.0
|
CA
|
B:PRO155
|
3.4
|
19.0
|
1.0
|
CB
|
B:SER158
|
3.5
|
13.8
|
1.0
|
C
|
B:PRO155
|
3.6
|
23.6
|
1.0
|
CB
|
B:GLN157
|
3.6
|
15.0
|
1.0
|
O
|
B:PRO155
|
3.7
|
23.7
|
1.0
|
CA
|
B:SER158
|
3.9
|
13.4
|
1.0
|
O
|
A:HOH332
|
3.9
|
20.9
|
1.0
|
N
|
B:GLN157
|
4.0
|
15.2
|
1.0
|
C
|
B:GLN157
|
4.0
|
15.8
|
1.0
|
O
|
B:HOH314
|
4.1
|
15.2
|
1.0
|
CA
|
B:GLN157
|
4.1
|
14.7
|
1.0
|
OG
|
B:SER158
|
4.4
|
31.0
|
1.0
|
N
|
B:THR156
|
4.4
|
29.4
|
1.0
|
C
|
B:THR156
|
4.7
|
15.5
|
1.0
|
CG
|
B:GLN157
|
4.7
|
15.3
|
1.0
|
CG
|
B:PRO155
|
4.8
|
21.3
|
1.0
|
O
|
B:HOH322
|
4.8
|
19.1
|
1.0
|
N
|
B:PRO155
|
4.8
|
22.1
|
1.0
|
|
Chlorine binding site 5 out
of 7 in 8vl8
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Chlorine Binding Sites List in 8vl8
Chlorine binding site 5 out
of 7 in the Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl203
b:43.4
occ:1.00
|
N
|
C:ASN149
|
3.1
|
28.1
|
1.0
|
N
|
C:GLU150
|
3.2
|
26.3
|
1.0
|
C
|
C:LYS147
|
3.3
|
21.2
|
1.0
|
CA
|
C:LYS147
|
3.4
|
20.2
|
1.0
|
N
|
C:ILE148
|
3.5
|
18.5
|
1.0
|
CB
|
C:ASN149
|
3.5
|
21.6
|
1.0
|
O
|
C:LYS147
|
3.7
|
27.7
|
1.0
|
CA
|
C:ASN149
|
3.7
|
27.4
|
1.0
|
CB
|
C:LYS147
|
3.8
|
21.3
|
1.0
|
C
|
C:ASN149
|
3.9
|
27.6
|
1.0
|
CB
|
C:GLU150
|
4.0
|
22.9
|
1.0
|
C
|
C:ILE148
|
4.1
|
29.1
|
1.0
|
OD1
|
C:ASN149
|
4.2
|
30.3
|
1.0
|
CA
|
C:GLU150
|
4.2
|
25.3
|
1.0
|
CA
|
C:ILE148
|
4.3
|
17.7
|
1.0
|
CG
|
C:ASN149
|
4.4
|
27.0
|
1.0
|
CG
|
C:LYS147
|
4.4
|
26.8
|
1.0
|
N
|
C:LYS147
|
4.7
|
24.9
|
1.0
|
OE1
|
C:GLU150
|
4.8
|
24.5
|
1.0
|
CG2
|
C:ILE148
|
4.9
|
23.7
|
1.0
|
O
|
C:GLY146
|
4.9
|
33.6
|
1.0
|
CD
|
C:LYS147
|
5.0
|
33.8
|
1.0
|
|
Chlorine binding site 6 out
of 7 in 8vl8
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Chlorine Binding Sites List in 8vl8
Chlorine binding site 6 out
of 7 in the Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl202
b:48.5
occ:1.00
|
N
|
D:ASN149
|
3.0
|
20.1
|
1.0
|
N
|
D:GLU150
|
3.2
|
21.0
|
1.0
|
C
|
D:LYS147
|
3.3
|
22.7
|
1.0
|
CB
|
D:ASN149
|
3.3
|
22.3
|
1.0
|
CA
|
D:LYS147
|
3.4
|
21.0
|
1.0
|
N
|
D:ILE148
|
3.5
|
19.7
|
1.0
|
CA
|
D:ASN149
|
3.6
|
27.3
|
1.0
|
CB
|
D:LYS147
|
3.7
|
22.0
|
1.0
|
O
|
D:LYS147
|
3.8
|
20.7
|
1.0
|
CB
|
D:GLU150
|
3.9
|
22.5
|
1.0
|
C
|
D:ASN149
|
4.0
|
20.2
|
1.0
|
ND2
|
D:ASN149
|
4.0
|
35.4
|
1.0
|
C
|
D:ILE148
|
4.1
|
34.4
|
1.0
|
CG
|
D:ASN149
|
4.2
|
26.0
|
1.0
|
CA
|
D:GLU150
|
4.2
|
21.1
|
1.0
|
CG
|
D:LYS147
|
4.3
|
29.7
|
1.0
|
CA
|
D:ILE148
|
4.4
|
27.4
|
1.0
|
OE1
|
D:GLU150
|
4.5
|
38.4
|
1.0
|
N
|
D:LYS147
|
4.8
|
23.1
|
1.0
|
CG2
|
D:ILE148
|
4.9
|
18.8
|
1.0
|
O
|
D:GLY146
|
5.0
|
24.0
|
1.0
|
|
Chlorine binding site 7 out
of 7 in 8vl8
Go back to
Chlorine Binding Sites List in 8vl8
Chlorine binding site 7 out
of 7 in the Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of Salmonella Enterica Typhimurium Taxis to Serine and Repellents (Tsr) Ligand-Binding Domain with L-Ser, pH 7 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl203
b:51.7
occ:1.00
|
N
|
D:SER158
|
3.3
|
21.1
|
1.0
|
O
|
C:HOH332
|
3.4
|
24.6
|
1.0
|
CB
|
D:PRO155
|
3.4
|
22.1
|
1.0
|
CA
|
D:PRO155
|
3.4
|
26.5
|
1.0
|
O
|
D:PRO155
|
3.5
|
20.0
|
1.0
|
C
|
D:PRO155
|
3.6
|
29.2
|
1.0
|
CB
|
D:SER158
|
3.7
|
23.4
|
1.0
|
CB
|
D:GLN157
|
3.7
|
20.5
|
1.0
|
N
|
D:GLN157
|
3.8
|
19.5
|
1.0
|
CA
|
D:SER158
|
4.1
|
22.4
|
1.0
|
C
|
D:GLN157
|
4.1
|
29.9
|
1.0
|
OG
|
D:SER158
|
4.1
|
37.9
|
1.0
|
CA
|
D:GLN157
|
4.1
|
22.8
|
1.0
|
O
|
D:HOH303
|
4.3
|
24.4
|
1.0
|
N
|
D:THR156
|
4.5
|
28.8
|
1.0
|
CG
|
D:GLN157
|
4.7
|
22.0
|
1.0
|
C
|
D:THR156
|
4.8
|
18.6
|
1.0
|
CG
|
D:PRO155
|
4.8
|
22.5
|
1.0
|
N
|
D:PRO155
|
4.9
|
24.1
|
1.0
|
O
|
C:HOH330
|
4.9
|
31.5
|
1.0
|
O
|
D:HOH319
|
5.0
|
43.6
|
1.0
|
|
Reference:
S.Glenn,
Z.Gentry-Lear,
M.Shavlik,
M.J.Harms,
T.J.Asaki,
A.Baylink.
Human Serum Is A Potent Chemoattractant For Enterobacteriaceae Species Associated with Gastrointestinal Bleeding Elife 2024.
ISSN: ESSN 2050-084X
DOI: 10.7554/ELIFE.93178.1
Page generated: Tue Jul 30 13:41:24 2024
|