Chlorine in PDB 1odl: Purine Nucleoside Phosphorylase From Thermus Thermophilus
Protein crystallography data
The structure of Purine Nucleoside Phosphorylase From Thermus Thermophilus, PDB code: 1odl
was solved by
T.H.Tahirov,
E.Inagaki,
M.Miyano,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
19.99 /
2.10
|
Space group
|
P 43 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
132.002,
132.002,
170.145,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
18.7 /
23.4
|
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Purine Nucleoside Phosphorylase From Thermus Thermophilus
(pdb code 1odl). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the
Purine Nucleoside Phosphorylase From Thermus Thermophilus, PDB code: 1odl:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
Chlorine binding site 1 out
of 6 in 1odl
Go back to
Chlorine Binding Sites List in 1odl
Chlorine binding site 1 out
of 6 in the Purine Nucleoside Phosphorylase From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Purine Nucleoside Phosphorylase From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl1240
b:25.6
occ:1.00
|
O
|
A:HOH2051
|
3.1
|
13.4
|
1.0
|
CG
|
A:PRO57
|
3.1
|
17.5
|
1.0
|
N
|
A:GLU15
|
3.4
|
11.8
|
1.0
|
CA
|
A:ALA14
|
3.9
|
11.8
|
1.0
|
CB
|
A:PRO57
|
3.9
|
8.6
|
1.0
|
CB
|
A:ALA14
|
3.9
|
11.2
|
1.0
|
CG
|
A:GLU15
|
4.0
|
29.1
|
1.0
|
C
|
A:ALA14
|
4.1
|
11.9
|
1.0
|
CB
|
A:GLU15
|
4.1
|
18.1
|
1.0
|
CA
|
A:GLU15
|
4.4
|
14.3
|
1.0
|
CD
|
A:PRO57
|
4.4
|
13.6
|
1.0
|
CD
|
A:GLU15
|
4.5
|
33.0
|
1.0
|
O
|
A:PRO57
|
4.7
|
13.8
|
1.0
|
OE2
|
A:GLU15
|
5.0
|
33.5
|
1.0
|
|
Chlorine binding site 2 out
of 6 in 1odl
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Chlorine Binding Sites List in 1odl
Chlorine binding site 2 out
of 6 in the Purine Nucleoside Phosphorylase From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Purine Nucleoside Phosphorylase From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl1240
b:21.0
occ:1.00
|
O
|
B:HOH2048
|
3.0
|
10.1
|
1.0
|
N
|
B:GLU15
|
3.3
|
14.7
|
1.0
|
O
|
B:HOH2017
|
3.3
|
43.6
|
1.0
|
CB
|
B:PRO57
|
3.8
|
11.7
|
1.0
|
CA
|
B:ALA14
|
3.9
|
13.7
|
1.0
|
CB
|
B:ALA14
|
3.9
|
13.6
|
1.0
|
CG
|
B:GLU15
|
3.9
|
26.4
|
1.0
|
CB
|
B:GLU15
|
3.9
|
17.1
|
1.0
|
C
|
B:ALA14
|
4.1
|
15.3
|
1.0
|
CG
|
B:PRO57
|
4.2
|
15.9
|
1.0
|
O
|
B:HOH2003
|
4.2
|
43.4
|
1.0
|
CA
|
B:GLU15
|
4.2
|
16.0
|
1.0
|
CD
|
B:GLU15
|
4.4
|
31.2
|
1.0
|
OE2
|
B:GLU15
|
4.5
|
36.6
|
1.0
|
O
|
B:PRO57
|
4.6
|
10.8
|
1.0
|
CD
|
B:PRO57
|
4.6
|
15.5
|
1.0
|
NH2
|
B:ARG16
|
4.9
|
11.5
|
1.0
|
CA
|
B:PRO57
|
5.0
|
14.9
|
1.0
|
O
|
B:HOH2007
|
5.0
|
35.4
|
1.0
|
O
|
B:HOH2064
|
5.0
|
36.2
|
1.0
|
N
|
B:ARG16
|
5.0
|
14.1
|
1.0
|
|
Chlorine binding site 3 out
of 6 in 1odl
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Chlorine Binding Sites List in 1odl
Chlorine binding site 3 out
of 6 in the Purine Nucleoside Phosphorylase From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Purine Nucleoside Phosphorylase From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl1237
b:31.6
occ:1.00
|
O
|
C:HOH2036
|
3.1
|
24.6
|
1.0
|
N
|
C:GLU15
|
3.2
|
17.2
|
1.0
|
CG
|
C:GLU15
|
3.7
|
38.2
|
1.0
|
CA
|
C:ALA14
|
3.8
|
14.2
|
1.0
|
O
|
C:HOH2005
|
3.8
|
37.3
|
1.0
|
CB
|
C:GLU15
|
3.9
|
24.2
|
1.0
|
CB
|
C:PRO57
|
4.0
|
22.4
|
1.0
|
C
|
C:ALA14
|
4.0
|
16.7
|
1.0
|
CB
|
C:ALA14
|
4.0
|
12.5
|
1.0
|
CA
|
C:GLU15
|
4.2
|
18.8
|
1.0
|
CG
|
C:PRO57
|
4.2
|
24.3
|
1.0
|
CD
|
C:GLU15
|
4.4
|
44.7
|
1.0
|
O
|
C:HOH2008
|
4.7
|
34.4
|
1.0
|
CD
|
C:PRO57
|
4.7
|
23.4
|
1.0
|
OE1
|
C:GLU15
|
4.9
|
45.3
|
1.0
|
O
|
C:PRO57
|
4.9
|
26.2
|
1.0
|
OE2
|
C:GLU15
|
4.9
|
49.5
|
1.0
|
|
Chlorine binding site 4 out
of 6 in 1odl
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Chlorine Binding Sites List in 1odl
Chlorine binding site 4 out
of 6 in the Purine Nucleoside Phosphorylase From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Purine Nucleoside Phosphorylase From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl1238
b:41.4
occ:1.00
|
N
|
D:GLU15
|
3.2
|
25.9
|
1.0
|
O
|
D:HOH2009
|
3.2
|
39.8
|
1.0
|
CG
|
D:PRO57
|
3.5
|
36.9
|
1.0
|
CA
|
D:ALA14
|
3.7
|
24.8
|
1.0
|
CB
|
D:ALA14
|
3.8
|
19.2
|
1.0
|
CB
|
D:GLU15
|
3.8
|
23.1
|
1.0
|
CG
|
D:GLU15
|
3.8
|
32.3
|
1.0
|
C
|
D:ALA14
|
3.9
|
28.4
|
1.0
|
CA
|
D:GLU15
|
4.1
|
24.4
|
1.0
|
CB
|
D:PRO57
|
4.2
|
33.7
|
1.0
|
CD
|
D:GLU15
|
4.3
|
39.4
|
1.0
|
OE2
|
D:GLU15
|
4.4
|
41.4
|
1.0
|
O
|
D:PRO57
|
4.7
|
38.0
|
1.0
|
O
|
D:HOH2005
|
4.8
|
28.7
|
1.0
|
CD
|
D:PRO57
|
4.8
|
29.7
|
1.0
|
NH2
|
D:ARG16
|
4.9
|
41.5
|
1.0
|
|
Chlorine binding site 5 out
of 6 in 1odl
Go back to
Chlorine Binding Sites List in 1odl
Chlorine binding site 5 out
of 6 in the Purine Nucleoside Phosphorylase From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Purine Nucleoside Phosphorylase From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl1238
b:30.7
occ:1.00
|
N
|
E:GLU15
|
3.2
|
19.8
|
1.0
|
O
|
E:HOH2041
|
3.2
|
19.6
|
1.0
|
CB
|
E:ALA14
|
3.6
|
19.5
|
1.0
|
CA
|
E:ALA14
|
3.7
|
15.1
|
1.0
|
CB
|
E:PRO57
|
3.8
|
17.6
|
1.0
|
C
|
E:ALA14
|
3.9
|
19.1
|
1.0
|
CG
|
E:GLU15
|
4.0
|
29.3
|
1.0
|
CB
|
E:GLU15
|
4.0
|
21.9
|
1.0
|
CG
|
E:PRO57
|
4.1
|
19.7
|
1.0
|
O
|
E:HOH2011
|
4.2
|
36.4
|
1.0
|
CA
|
E:GLU15
|
4.2
|
22.6
|
1.0
|
CD
|
E:PRO57
|
4.6
|
15.7
|
1.0
|
O
|
E:PRO57
|
4.6
|
17.3
|
1.0
|
CD
|
E:GLU15
|
4.8
|
34.9
|
1.0
|
CA
|
E:PRO57
|
5.0
|
19.5
|
1.0
|
|
Chlorine binding site 6 out
of 6 in 1odl
Go back to
Chlorine Binding Sites List in 1odl
Chlorine binding site 6 out
of 6 in the Purine Nucleoside Phosphorylase From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Purine Nucleoside Phosphorylase From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Cl1237
b:20.3
occ:1.00
|
O
|
F:HOH2041
|
3.0
|
13.4
|
1.0
|
N
|
F:GLU15
|
3.3
|
13.7
|
1.0
|
CB
|
F:PRO57
|
3.7
|
12.9
|
1.0
|
CG
|
F:GLU15
|
3.8
|
28.1
|
1.0
|
CA
|
F:ALA14
|
3.9
|
16.4
|
1.0
|
CB
|
F:GLU15
|
3.9
|
19.2
|
1.0
|
CB
|
F:ALA14
|
4.0
|
11.5
|
1.0
|
C
|
F:ALA14
|
4.1
|
15.8
|
1.0
|
CG
|
F:PRO57
|
4.1
|
14.7
|
1.0
|
CA
|
F:GLU15
|
4.2
|
15.8
|
1.0
|
CD
|
F:GLU15
|
4.5
|
33.3
|
1.0
|
O
|
F:PRO57
|
4.6
|
18.9
|
1.0
|
CD
|
F:PRO57
|
4.6
|
14.1
|
1.0
|
OE2
|
F:GLU15
|
4.9
|
33.2
|
1.0
|
CA
|
F:PRO57
|
4.9
|
15.5
|
1.0
|
NH2
|
F:ARG16
|
4.9
|
10.0
|
1.0
|
|
Reference:
T.H.Tahirov,
E.Inagaki,
N.Ohshima,
T.Kitao,
C.Kuroishi,
Y.Ukita,
K.Takio,
M.Kobayashi,
S.Kuramitsu,
S.Yokoyama,
M.Miyano.
Crystal Structure of Purine Nucleoside Phosphorylase From Thermus Thermophilus J.Mol.Biol. V. 337 1149 2004.
ISSN: ISSN 0022-2836
PubMed: 15046984
DOI: 10.1016/J.JMB.2004.02.016
Page generated: Sat Jul 20 00:52:15 2024
|