Chlorine in PDB 2iuo: Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Enzymatic activity of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
All present enzymatic activity of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase:
4.2.1.104;
Protein crystallography data
The structure of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase, PDB code: 2iuo
was solved by
M.Guilloton,
M.A.Walsh,
A.Joachimiak,
M.P.Anderson,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
76.70 /
1.90
|
Space group
|
P 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
76.600,
80.750,
82.280,
70.02,
71.81,
66.34
|
R / Rfree (%)
|
14.9 /
20.8
|
Other elements in 2iuo:
The structure of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
(pdb code 2iuo). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 10 binding sites of Chlorine where determined in the
Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase, PDB code: 2iuo:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Chlorine binding site 1 out
of 10 in 2iuo
Go back to
Chlorine Binding Sites List in 2iuo
Chlorine binding site 1 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl1158
b:8.8
occ:0.50
|
BR
|
A:BR1157
|
0.4
|
12.9
|
0.5
|
O
|
A:HOH2164
|
3.0
|
16.5
|
1.0
|
N
|
A:ALA123
|
3.1
|
15.3
|
1.0
|
NE
|
D:ARG96
|
3.4
|
10.7
|
1.0
|
NH2
|
I:ARG96
|
3.4
|
8.5
|
1.0
|
CA
|
A:GLY122
|
3.4
|
14.5
|
1.0
|
CD
|
D:ARG96
|
3.6
|
6.7
|
1.0
|
CD1
|
A:ILE120
|
3.7
|
13.2
|
1.0
|
C
|
A:GLY122
|
3.8
|
15.8
|
1.0
|
N
|
A:ILE124
|
3.8
|
16.6
|
1.0
|
CG1
|
A:ILE124
|
3.9
|
13.7
|
1.0
|
BR
|
J:BR1157
|
4.1
|
14.0
|
0.5
|
CA
|
A:ALA123
|
4.1
|
15.6
|
1.0
|
CD1
|
J:ILE120
|
4.2
|
13.7
|
1.0
|
CD2
|
J:LEU151
|
4.3
|
15.7
|
0.3
|
CB
|
A:ILE124
|
4.3
|
15.8
|
1.0
|
C
|
A:ALA123
|
4.4
|
16.1
|
1.0
|
CB
|
A:ALA123
|
4.4
|
15.3
|
1.0
|
CZ
|
I:ARG96
|
4.4
|
10.4
|
1.0
|
NE
|
I:ARG96
|
4.5
|
10.6
|
1.0
|
CZ
|
D:ARG96
|
4.5
|
10.4
|
1.0
|
CG
|
D:ARG96
|
4.5
|
7.4
|
1.0
|
CL
|
J:CL1158
|
4.5
|
12.2
|
0.5
|
N
|
A:GLY122
|
4.7
|
13.6
|
1.0
|
CA
|
A:ILE124
|
4.7
|
17.1
|
1.0
|
CD2
|
A:LEU151
|
4.7
|
15.6
|
0.3
|
CD1
|
A:LEU151
|
4.8
|
19.0
|
0.3
|
NH2
|
D:ARG96
|
4.8
|
8.7
|
1.0
|
CD1
|
A:LEU151
|
4.9
|
17.6
|
0.7
|
CD1
|
J:LEU151
|
4.9
|
25.2
|
0.7
|
O
|
A:GLY122
|
5.0
|
16.5
|
1.0
|
|
Chlorine binding site 2 out
of 10 in 2iuo
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Chlorine Binding Sites List in 2iuo
Chlorine binding site 2 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl1158
b:12.8
occ:0.50
|
BR
|
B:BR1157
|
0.5
|
12.8
|
0.5
|
O
|
B:HOH2187
|
3.1
|
17.2
|
1.0
|
N
|
B:ALA123
|
3.2
|
17.1
|
1.0
|
NH2
|
A:ARG96
|
3.3
|
9.2
|
1.0
|
CA
|
B:GLY122
|
3.6
|
14.4
|
1.0
|
NE
|
F:ARG96
|
3.6
|
7.4
|
1.0
|
CG1
|
B:ILE124
|
3.8
|
18.4
|
1.0
|
N
|
B:ILE124
|
3.8
|
19.1
|
1.0
|
CD1
|
B:ILE120
|
3.9
|
14.2
|
1.0
|
CD
|
F:ARG96
|
3.9
|
8.0
|
1.0
|
C
|
B:GLY122
|
3.9
|
16.3
|
1.0
|
BR
|
D:BR1157
|
4.0
|
15.1
|
0.5
|
CB
|
B:ILE124
|
4.1
|
20.1
|
1.0
|
CA
|
B:ALA123
|
4.2
|
17.6
|
1.0
|
CD1
|
D:ILE120
|
4.2
|
15.9
|
1.0
|
C
|
B:ALA123
|
4.3
|
18.2
|
1.0
|
CZ
|
A:ARG96
|
4.4
|
10.3
|
1.0
|
CD1
|
D:LEU151
|
4.4
|
28.0
|
1.0
|
CB
|
B:ALA123
|
4.5
|
17.4
|
1.0
|
NE
|
A:ARG96
|
4.5
|
9.5
|
1.0
|
CA
|
B:ILE124
|
4.6
|
19.6
|
1.0
|
CL
|
D:CL1158
|
4.6
|
16.4
|
0.5
|
O
|
B:HOH2207
|
4.7
|
37.6
|
1.0
|
CG
|
F:ARG96
|
4.7
|
8.9
|
1.0
|
CZ
|
F:ARG96
|
4.8
|
9.5
|
1.0
|
N
|
B:GLY122
|
4.8
|
12.4
|
1.0
|
OE2
|
F:GLU99
|
4.9
|
9.2
|
1.0
|
NH2
|
F:ARG96
|
4.9
|
7.8
|
1.0
|
CD1
|
B:LEU151
|
5.0
|
23.5
|
1.0
|
|
Chlorine binding site 3 out
of 10 in 2iuo
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Chlorine Binding Sites List in 2iuo
Chlorine binding site 3 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl1158
b:13.2
occ:0.50
|
BR
|
C:BR1157
|
0.6
|
13.1
|
0.5
|
N
|
C:ALA123
|
3.1
|
18.4
|
1.0
|
NH2
|
J:ARG96
|
3.2
|
8.6
|
1.0
|
O
|
C:HOH2171
|
3.2
|
23.9
|
1.0
|
CA
|
C:GLY122
|
3.5
|
16.3
|
1.0
|
N
|
C:ILE124
|
3.6
|
19.2
|
1.0
|
NE
|
H:ARG96
|
3.7
|
11.6
|
1.0
|
CG1
|
C:ILE124
|
3.8
|
15.8
|
1.0
|
C
|
C:GLY122
|
3.8
|
17.1
|
1.0
|
CD
|
H:ARG96
|
3.8
|
9.4
|
1.0
|
CD1
|
C:ILE120
|
3.9
|
14.8
|
1.0
|
CB
|
C:ILE124
|
4.0
|
18.9
|
1.0
|
CA
|
C:ALA123
|
4.0
|
18.3
|
1.0
|
BR
|
I:BR1157
|
4.1
|
16.7
|
0.5
|
C
|
C:ALA123
|
4.2
|
18.3
|
1.0
|
CZ
|
J:ARG96
|
4.3
|
11.5
|
1.0
|
CB
|
C:ALA123
|
4.4
|
18.7
|
1.0
|
CD1
|
I:ILE120
|
4.4
|
15.7
|
1.0
|
CA
|
C:ILE124
|
4.5
|
19.5
|
1.0
|
NE
|
J:ARG96
|
4.5
|
10.5
|
1.0
|
CG
|
H:ARG96
|
4.8
|
9.4
|
1.0
|
CZ
|
H:ARG96
|
4.8
|
13.9
|
1.0
|
N
|
C:GLY122
|
4.8
|
14.4
|
1.0
|
CD1
|
I:LEU151
|
4.8
|
25.4
|
1.0
|
O
|
C:HOH2193
|
4.8
|
30.7
|
1.0
|
OE2
|
H:GLU99
|
4.8
|
10.9
|
1.0
|
CL
|
I:CL1158
|
4.8
|
15.1
|
0.5
|
O
|
C:GLY122
|
5.0
|
18.9
|
1.0
|
CD1
|
C:LEU151
|
5.0
|
26.1
|
1.0
|
|
Chlorine binding site 4 out
of 10 in 2iuo
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Chlorine Binding Sites List in 2iuo
Chlorine binding site 4 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl1158
b:16.4
occ:0.50
|
BR
|
D:BR1157
|
0.7
|
15.1
|
0.5
|
O
|
D:HOH2165
|
2.6
|
19.4
|
1.0
|
N
|
D:ALA123
|
3.1
|
23.8
|
1.0
|
NH2
|
F:ARG96
|
3.3
|
7.8
|
1.0
|
CA
|
D:GLY122
|
3.5
|
21.5
|
1.0
|
NE
|
A:ARG96
|
3.7
|
9.5
|
1.0
|
N
|
D:ILE124
|
3.7
|
22.9
|
1.0
|
C
|
D:GLY122
|
3.8
|
23.5
|
1.0
|
CG1
|
D:ILE124
|
3.9
|
20.0
|
1.0
|
CD1
|
D:ILE120
|
3.9
|
15.9
|
1.0
|
CD
|
A:ARG96
|
3.9
|
7.4
|
1.0
|
CA
|
D:ALA123
|
4.1
|
23.6
|
1.0
|
CB
|
D:ILE124
|
4.1
|
23.1
|
1.0
|
BR
|
B:BR1157
|
4.2
|
12.8
|
0.5
|
C
|
D:ALA123
|
4.3
|
23.4
|
1.0
|
CD1
|
B:ILE120
|
4.3
|
14.2
|
1.0
|
CZ
|
F:ARG96
|
4.4
|
9.5
|
1.0
|
CB
|
D:ALA123
|
4.5
|
24.2
|
1.0
|
NE
|
F:ARG96
|
4.5
|
7.4
|
1.0
|
CA
|
D:ILE124
|
4.6
|
22.6
|
1.0
|
CL
|
B:CL1158
|
4.6
|
12.8
|
0.5
|
CD1
|
B:LEU151
|
4.7
|
23.5
|
1.0
|
N
|
D:GLY122
|
4.7
|
19.6
|
1.0
|
CG
|
A:ARG96
|
4.7
|
10.2
|
1.0
|
CZ
|
A:ARG96
|
4.8
|
10.3
|
1.0
|
OE2
|
A:GLU99
|
4.8
|
13.6
|
1.0
|
NH2
|
A:ARG96
|
5.0
|
9.2
|
1.0
|
O
|
D:HOH2191
|
5.0
|
23.6
|
1.0
|
|
Chlorine binding site 5 out
of 10 in 2iuo
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Chlorine Binding Sites List in 2iuo
Chlorine binding site 5 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl1158
b:15.1
occ:0.50
|
BR
|
E:BR1157
|
0.6
|
17.1
|
0.5
|
O
|
E:HOH2180
|
2.5
|
15.4
|
1.0
|
N
|
E:ALA123
|
3.4
|
24.6
|
1.0
|
NH2
|
B:ARG96
|
3.4
|
11.5
|
1.0
|
CA
|
E:GLY122
|
3.5
|
23.4
|
1.0
|
CD1
|
E:ILE120
|
3.7
|
15.3
|
1.0
|
NE
|
G:ARG96
|
3.8
|
9.8
|
1.0
|
CG1
|
E:ILE124
|
3.8
|
20.9
|
1.0
|
CD1
|
F:ILE120
|
3.8
|
16.0
|
1.0
|
N
|
E:ILE124
|
3.8
|
22.4
|
1.0
|
CD2
|
F:LEU151
|
3.9
|
16.9
|
0.2
|
BR
|
F:BR1157
|
3.9
|
16.9
|
0.5
|
CB
|
E:ILE124
|
3.9
|
22.4
|
1.0
|
C
|
E:GLY122
|
4.0
|
24.1
|
1.0
|
CD
|
G:ARG96
|
4.2
|
11.2
|
1.0
|
CA
|
E:ALA123
|
4.4
|
23.6
|
1.0
|
CD1
|
F:LEU151
|
4.4
|
21.3
|
0.8
|
CZ
|
B:ARG96
|
4.5
|
14.3
|
1.0
|
C
|
E:ALA123
|
4.5
|
24.0
|
1.0
|
CL
|
F:CL1158
|
4.5
|
16.8
|
0.5
|
CD1
|
E:LEU151
|
4.6
|
23.5
|
0.8
|
NE
|
B:ARG96
|
4.6
|
13.4
|
1.0
|
O
|
E:HOH2203
|
4.6
|
30.0
|
1.0
|
CA
|
E:ILE124
|
4.6
|
23.0
|
1.0
|
N
|
E:GLY122
|
4.7
|
21.1
|
1.0
|
CB
|
E:ALA123
|
4.7
|
23.8
|
1.0
|
CZ
|
G:ARG96
|
4.8
|
11.6
|
1.0
|
NH2
|
G:ARG96
|
5.0
|
12.8
|
1.0
|
OE2
|
G:GLU99
|
5.0
|
11.7
|
1.0
|
CG
|
G:ARG96
|
5.0
|
9.9
|
1.0
|
|
Chlorine binding site 6 out
of 10 in 2iuo
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Chlorine Binding Sites List in 2iuo
Chlorine binding site 6 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Cl1158
b:16.8
occ:0.50
|
BR
|
F:BR1157
|
0.7
|
16.9
|
0.5
|
O
|
F:HOH2176
|
2.6
|
12.4
|
1.0
|
N
|
F:ALA123
|
3.3
|
25.2
|
1.0
|
NH2
|
G:ARG96
|
3.3
|
12.8
|
1.0
|
CA
|
F:GLY122
|
3.4
|
23.8
|
1.0
|
CG1
|
F:ILE124
|
3.6
|
23.9
|
1.0
|
NE
|
B:ARG96
|
3.7
|
13.4
|
1.0
|
N
|
F:ILE124
|
3.8
|
23.5
|
1.0
|
C
|
F:GLY122
|
3.9
|
24.9
|
1.0
|
CB
|
F:ILE124
|
4.0
|
24.2
|
1.0
|
CD
|
B:ARG96
|
4.0
|
12.9
|
1.0
|
BR
|
E:BR1157
|
4.0
|
17.1
|
0.5
|
CD2
|
E:LEU151
|
4.1
|
17.2
|
0.2
|
CD1
|
F:ILE120
|
4.1
|
16.0
|
1.0
|
CA
|
F:ALA123
|
4.3
|
24.5
|
1.0
|
CD1
|
E:ILE120
|
4.4
|
15.3
|
1.0
|
CZ
|
G:ARG96
|
4.4
|
11.6
|
1.0
|
C
|
F:ALA123
|
4.4
|
24.4
|
1.0
|
CL
|
E:CL1158
|
4.5
|
15.1
|
0.5
|
CA
|
F:ILE124
|
4.5
|
24.3
|
1.0
|
NE
|
G:ARG96
|
4.6
|
9.8
|
1.0
|
CD1
|
E:LEU151
|
4.6
|
23.5
|
0.8
|
N
|
F:GLY122
|
4.7
|
21.4
|
1.0
|
CB
|
F:ALA123
|
4.7
|
25.0
|
1.0
|
O
|
F:HOH2205
|
4.8
|
40.2
|
1.0
|
CZ
|
B:ARG96
|
4.8
|
14.3
|
1.0
|
OE2
|
B:GLU99
|
4.9
|
12.3
|
1.0
|
CG
|
B:ARG96
|
4.9
|
9.1
|
1.0
|
CD1
|
F:ILE124
|
4.9
|
25.1
|
1.0
|
NH2
|
B:ARG96
|
5.0
|
11.5
|
1.0
|
CG1
|
E:ILE120
|
5.0
|
16.1
|
1.0
|
|
Chlorine binding site 7 out
of 10 in 2iuo
Go back to
Chlorine Binding Sites List in 2iuo
Chlorine binding site 7 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Cl1158
b:16.2
occ:0.50
|
BR
|
G:BR1157
|
0.6
|
13.6
|
0.5
|
O
|
G:HOH2149
|
3.0
|
20.2
|
1.0
|
N
|
G:ALA123
|
3.1
|
19.2
|
1.0
|
NH2
|
C:ARG96
|
3.3
|
9.2
|
1.0
|
NE
|
E:ARG96
|
3.3
|
10.0
|
1.0
|
CA
|
G:GLY122
|
3.4
|
17.5
|
1.0
|
CD
|
E:ARG96
|
3.6
|
9.2
|
1.0
|
N
|
G:ILE124
|
3.7
|
20.4
|
1.0
|
C
|
G:GLY122
|
3.8
|
18.8
|
1.0
|
CD1
|
G:ILE120
|
3.8
|
14.4
|
1.0
|
CG1
|
G:ILE124
|
3.9
|
18.9
|
1.0
|
BR
|
H:BR1157
|
4.1
|
14.3
|
0.5
|
CA
|
G:ALA123
|
4.1
|
19.9
|
1.0
|
CD1
|
H:ILE120
|
4.2
|
16.8
|
1.0
|
CB
|
G:ILE124
|
4.3
|
20.9
|
1.0
|
CZ
|
C:ARG96
|
4.3
|
12.4
|
1.0
|
C
|
G:ALA123
|
4.4
|
20.1
|
1.0
|
CZ
|
E:ARG96
|
4.5
|
10.3
|
1.0
|
NE
|
C:ARG96
|
4.5
|
12.6
|
1.0
|
CB
|
G:ALA123
|
4.5
|
19.3
|
1.0
|
CG
|
E:ARG96
|
4.5
|
10.9
|
1.0
|
CA
|
G:ILE124
|
4.6
|
21.1
|
1.0
|
N
|
G:GLY122
|
4.7
|
15.8
|
1.0
|
CL
|
H:CL1158
|
4.7
|
12.1
|
0.5
|
NH2
|
E:ARG96
|
4.8
|
8.6
|
1.0
|
OE2
|
E:GLU99
|
4.8
|
14.1
|
1.0
|
CD1
|
H:LEU151
|
4.9
|
26.1
|
1.0
|
CD1
|
G:LEU151
|
5.0
|
25.3
|
1.0
|
O
|
G:GLY122
|
5.0
|
18.8
|
1.0
|
|
Chlorine binding site 8 out
of 10 in 2iuo
Go back to
Chlorine Binding Sites List in 2iuo
Chlorine binding site 8 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 8 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Cl1158
b:12.1
occ:0.50
|
BR
|
H:BR1157
|
0.7
|
14.3
|
0.5
|
O
|
H:HOH2160
|
2.9
|
22.8
|
1.0
|
N
|
H:ALA123
|
3.1
|
19.5
|
1.0
|
NH2
|
E:ARG96
|
3.3
|
8.6
|
1.0
|
CA
|
H:GLY122
|
3.5
|
19.6
|
1.0
|
CG1
|
H:ILE124
|
3.5
|
18.4
|
1.0
|
N
|
H:ILE124
|
3.6
|
20.3
|
1.0
|
C
|
H:GLY122
|
3.7
|
20.3
|
1.0
|
NE
|
C:ARG96
|
3.8
|
12.6
|
1.0
|
CB
|
H:ILE124
|
4.0
|
21.1
|
1.0
|
CD1
|
H:ILE120
|
4.0
|
16.8
|
1.0
|
CD
|
C:ARG96
|
4.1
|
11.3
|
1.0
|
CA
|
H:ALA123
|
4.1
|
19.3
|
1.0
|
CD1
|
G:ILE120
|
4.1
|
14.4
|
1.0
|
BR
|
G:BR1157
|
4.1
|
13.6
|
0.5
|
C
|
H:ALA123
|
4.2
|
18.9
|
1.0
|
CZ
|
E:ARG96
|
4.4
|
10.3
|
1.0
|
CA
|
H:ILE124
|
4.4
|
21.1
|
1.0
|
NE
|
E:ARG96
|
4.5
|
10.0
|
1.0
|
CD1
|
G:LEU151
|
4.5
|
25.3
|
1.0
|
CB
|
H:ALA123
|
4.6
|
18.8
|
1.0
|
CL
|
G:CL1158
|
4.7
|
16.2
|
0.5
|
N
|
H:GLY122
|
4.8
|
18.6
|
1.0
|
OE2
|
C:GLU99
|
4.8
|
12.2
|
1.0
|
CZ
|
C:ARG96
|
4.9
|
12.4
|
1.0
|
CD1
|
H:ILE124
|
4.9
|
20.9
|
1.0
|
CG
|
C:ARG96
|
4.9
|
9.0
|
1.0
|
O
|
H:GLY122
|
4.9
|
21.1
|
1.0
|
CD1
|
H:LEU151
|
5.0
|
26.1
|
1.0
|
O
|
H:HOH2182
|
5.0
|
31.4
|
1.0
|
|
Chlorine binding site 9 out
of 10 in 2iuo
Go back to
Chlorine Binding Sites List in 2iuo
Chlorine binding site 9 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 9 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
I:Cl1158
b:15.1
occ:0.50
|
BR
|
I:BR1157
|
0.8
|
16.7
|
0.5
|
O
|
I:HOH2157
|
2.9
|
20.6
|
1.0
|
N
|
I:ALA123
|
3.1
|
22.9
|
1.0
|
NH2
|
H:ARG96
|
3.3
|
14.6
|
1.0
|
CA
|
I:GLY122
|
3.5
|
20.8
|
1.0
|
N
|
I:ILE124
|
3.5
|
22.4
|
1.0
|
CG1
|
I:ILE124
|
3.6
|
23.2
|
1.0
|
NE
|
J:ARG96
|
3.7
|
10.5
|
1.0
|
C
|
I:GLY122
|
3.8
|
22.6
|
1.0
|
CB
|
I:ILE124
|
3.9
|
23.3
|
1.0
|
CD
|
J:ARG96
|
3.9
|
10.6
|
1.0
|
CA
|
I:ALA123
|
4.0
|
22.8
|
1.0
|
CD1
|
I:ILE120
|
4.1
|
15.7
|
1.0
|
C
|
I:ALA123
|
4.1
|
22.6
|
1.0
|
O
|
I:HOH2153
|
4.2
|
52.3
|
1.0
|
CB
|
I:ALA123
|
4.3
|
21.9
|
1.0
|
BR
|
C:BR1157
|
4.3
|
13.1
|
0.5
|
CD1
|
C:ILE120
|
4.3
|
14.8
|
1.0
|
CA
|
I:ILE124
|
4.3
|
23.7
|
1.0
|
CZ
|
H:ARG96
|
4.4
|
13.9
|
1.0
|
CD1
|
C:LEU151
|
4.6
|
26.1
|
1.0
|
NE
|
H:ARG96
|
4.6
|
11.6
|
1.0
|
CG
|
J:ARG96
|
4.7
|
10.4
|
1.0
|
OE2
|
J:GLU99
|
4.7
|
14.6
|
1.0
|
N
|
I:GLY122
|
4.8
|
17.6
|
1.0
|
CZ
|
J:ARG96
|
4.8
|
11.5
|
1.0
|
CL
|
C:CL1158
|
4.8
|
13.2
|
0.5
|
O
|
I:HOH2172
|
4.9
|
35.3
|
1.0
|
CD1
|
I:ILE124
|
4.9
|
23.9
|
1.0
|
|
Chlorine binding site 10 out
of 10 in 2iuo
Go back to
Chlorine Binding Sites List in 2iuo
Chlorine binding site 10 out
of 10 in the Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 10 of Site Directed Mutagenesis of Key Residues Involved in the Catalytic Mechanism of Cyanase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
J:Cl1158
b:12.2
occ:0.50
|
BR
|
J:BR1157
|
0.6
|
14.0
|
0.5
|
O
|
J:HOH2186
|
2.9
|
19.5
|
1.0
|
NH2
|
D:ARG96
|
3.2
|
8.7
|
1.0
|
N
|
J:ALA123
|
3.3
|
19.4
|
1.0
|
CA
|
J:GLY122
|
3.6
|
18.6
|
1.0
|
CG1
|
J:ILE124
|
3.7
|
16.9
|
1.0
|
N
|
J:ILE124
|
3.7
|
20.0
|
1.0
|
NE
|
I:ARG96
|
3.7
|
10.6
|
1.0
|
CB
|
J:ILE124
|
4.0
|
21.1
|
1.0
|
C
|
J:GLY122
|
4.0
|
19.4
|
1.0
|
CD1
|
A:LEU151
|
4.0
|
19.0
|
0.3
|
CD
|
I:ARG96
|
4.0
|
7.5
|
1.0
|
CD1
|
A:ILE120
|
4.0
|
13.2
|
1.0
|
CD1
|
J:ILE120
|
4.1
|
13.7
|
1.0
|
BR
|
A:BR1157
|
4.1
|
12.9
|
0.5
|
CA
|
J:ALA123
|
4.2
|
19.1
|
1.0
|
CZ
|
D:ARG96
|
4.2
|
10.4
|
1.0
|
C
|
J:ALA123
|
4.3
|
19.5
|
1.0
|
NE
|
D:ARG96
|
4.3
|
10.7
|
1.0
|
CD1
|
J:LEU151
|
4.4
|
25.2
|
0.7
|
CA
|
J:ILE124
|
4.4
|
20.6
|
1.0
|
CL
|
A:CL1158
|
4.5
|
8.8
|
0.5
|
CB
|
J:ALA123
|
4.6
|
18.4
|
1.0
|
CD1
|
A:LEU151
|
4.7
|
17.6
|
0.7
|
O
|
J:HOH2201
|
4.9
|
52.9
|
1.0
|
N
|
J:GLY122
|
4.9
|
18.0
|
1.0
|
CZ
|
I:ARG96
|
4.9
|
10.4
|
1.0
|
O
|
J:HOH2184
|
4.9
|
58.9
|
1.0
|
CD1
|
J:ILE124
|
4.9
|
16.7
|
1.0
|
CG
|
I:ARG96
|
4.9
|
7.9
|
1.0
|
OE2
|
I:GLU99
|
4.9
|
11.7
|
1.0
|
|
Reference:
M.Guilloton,
M.A.Walsh,
A.Joachimiak,
P.M.Anderson.
A Twin Set of Low Pka Arginines Ensures the Concerted Acid Base Catalytic Mechanism of Cyanase To Be Published.
Page generated: Sat Jul 20 08:23:45 2024
|