Sodium in PDB 2ahr: Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes
Enzymatic activity of Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes
All present enzymatic activity of Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes:
1.5.1.2;
Protein crystallography data
The structure of Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes, PDB code: 2ahr
was solved by
B.Nocek,
L.Lezondra,
D.Holzle,
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)
|
50.00 /
2.15
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
171.631,
109.646,
84.033,
90.00,
96.08,
90.00
|
R / Rfree (%)
|
17.3 /
21
|
Sodium Binding Sites:
The binding sites of Sodium atom in the Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes
(pdb code 2ahr). This binding sites where shown within
5.0 Angstroms radius around Sodium atom.
In total 5 binding sites of Sodium where determined in the
Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes, PDB code: 2ahr:
Jump to Sodium binding site number:
1;
2;
3;
4;
5;
Sodium binding site 1 out
of 5 in 2ahr
Go back to
Sodium Binding Sites List in 2ahr
Sodium binding site 1 out
of 5 in the Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 1 of Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na1257
b:41.4
occ:1.00
|
O
|
A:HOH1579
|
2.3
|
43.0
|
1.0
|
O
|
A:GLY89
|
2.3
|
38.1
|
1.0
|
O
|
A:LEU256
|
2.4
|
42.5
|
1.0
|
O
|
A:HOH1509
|
2.5
|
36.5
|
1.0
|
O
|
A:ALA253
|
2.6
|
35.8
|
1.0
|
O
|
A:LYS254
|
2.8
|
38.7
|
1.0
|
C
|
A:GLY89
|
3.2
|
38.6
|
1.0
|
C
|
A:LYS254
|
3.4
|
38.4
|
1.0
|
C
|
A:LEU256
|
3.5
|
42.7
|
1.0
|
CA
|
A:GLY89
|
3.5
|
37.7
|
1.0
|
NH1
|
A:ARG94
|
3.6
|
59.4
|
1.0
|
CA
|
A:LYS254
|
3.7
|
37.5
|
1.0
|
C
|
A:ALA253
|
3.7
|
35.6
|
1.0
|
N
|
A:LEU256
|
4.0
|
41.1
|
1.0
|
N
|
A:LYS254
|
4.1
|
36.3
|
1.0
|
CA
|
A:LEU256
|
4.2
|
41.7
|
1.0
|
N
|
A:SER255
|
4.3
|
38.6
|
1.0
|
O
|
A:HOH1517
|
4.4
|
59.4
|
1.0
|
OXT
|
A:LEU256
|
4.4
|
43.8
|
1.0
|
C
|
A:SER255
|
4.5
|
40.5
|
1.0
|
CB
|
A:LEU256
|
4.5
|
42.0
|
1.0
|
N
|
A:ILE90
|
4.5
|
39.1
|
1.0
|
O
|
A:HOH1572
|
4.7
|
44.1
|
1.0
|
CA
|
A:SER255
|
4.9
|
40.0
|
1.0
|
OD2
|
A:ASP156
|
4.9
|
36.1
|
1.0
|
CZ
|
A:ARG94
|
4.9
|
59.0
|
1.0
|
N
|
A:GLY89
|
4.9
|
37.2
|
1.0
|
CA
|
A:ALA253
|
5.0
|
35.5
|
1.0
|
|
Sodium binding site 2 out
of 5 in 2ahr
Go back to
Sodium Binding Sites List in 2ahr
Sodium binding site 2 out
of 5 in the Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 2 of Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na1258
b:46.3
occ:1.00
|
O
|
B:GLY89
|
2.3
|
43.1
|
1.0
|
O
|
B:HOH1566
|
2.4
|
41.6
|
1.0
|
O
|
B:LEU256
|
2.4
|
49.9
|
1.0
|
O
|
B:HOH1511
|
2.4
|
38.8
|
1.0
|
O
|
B:ALA253
|
2.5
|
40.2
|
1.0
|
O
|
B:LYS254
|
2.9
|
43.9
|
1.0
|
C
|
B:GLY89
|
3.3
|
43.7
|
1.0
|
C
|
B:LYS254
|
3.4
|
43.5
|
1.0
|
CA
|
B:GLY89
|
3.5
|
43.1
|
1.0
|
C
|
B:LEU256
|
3.5
|
49.7
|
1.0
|
C
|
B:ALA253
|
3.6
|
39.8
|
1.0
|
NH1
|
B:ARG94
|
3.6
|
54.9
|
1.0
|
CA
|
B:LYS254
|
3.7
|
42.4
|
1.0
|
O
|
B:HOH1537
|
3.8
|
65.8
|
1.0
|
O
|
B:HOH1593
|
4.0
|
59.6
|
1.0
|
N
|
B:LYS254
|
4.1
|
40.6
|
1.0
|
N
|
B:LEU256
|
4.1
|
48.4
|
1.0
|
CA
|
B:LEU256
|
4.2
|
49.3
|
1.0
|
CB
|
B:LEU256
|
4.4
|
49.3
|
1.0
|
OXT
|
B:LEU256
|
4.4
|
50.1
|
1.0
|
N
|
B:SER255
|
4.4
|
44.9
|
1.0
|
N
|
B:ILE90
|
4.5
|
43.8
|
1.0
|
C
|
B:SER255
|
4.6
|
47.5
|
1.0
|
OD2
|
B:ASP156
|
4.7
|
40.1
|
1.0
|
O
|
B:HOH1558
|
4.7
|
47.8
|
1.0
|
CZ
|
B:ARG94
|
4.8
|
57.4
|
1.0
|
CA
|
B:ALA253
|
4.9
|
38.9
|
1.0
|
N
|
B:GLY89
|
4.9
|
43.1
|
1.0
|
|
Sodium binding site 3 out
of 5 in 2ahr
Go back to
Sodium Binding Sites List in 2ahr
Sodium binding site 3 out
of 5 in the Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 3 of Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Na1259
b:48.4
occ:1.00
|
O
|
C:GLY89
|
2.4
|
51.4
|
1.0
|
O
|
C:HOH1574
|
2.4
|
50.9
|
1.0
|
O
|
C:ALA253
|
2.5
|
43.0
|
1.0
|
O
|
C:LEU256
|
2.5
|
49.5
|
1.0
|
O
|
C:HOH1511
|
2.6
|
46.0
|
1.0
|
O
|
C:LYS254
|
2.7
|
45.8
|
1.0
|
C
|
C:LYS254
|
3.3
|
45.4
|
1.0
|
C
|
C:GLY89
|
3.3
|
51.6
|
1.0
|
CA
|
C:GLY89
|
3.5
|
51.3
|
1.0
|
C
|
C:LEU256
|
3.6
|
49.6
|
1.0
|
C
|
C:ALA253
|
3.6
|
42.8
|
1.0
|
CA
|
C:LYS254
|
3.6
|
44.6
|
1.0
|
O
|
C:HOH1549
|
3.8
|
59.4
|
1.0
|
N
|
C:LEU256
|
3.9
|
48.2
|
1.0
|
NH1
|
C:ARG94
|
3.9
|
67.5
|
1.0
|
N
|
C:LYS254
|
4.1
|
43.4
|
1.0
|
CA
|
C:LEU256
|
4.1
|
49.1
|
1.0
|
N
|
C:SER255
|
4.3
|
45.9
|
1.0
|
CB
|
C:LEU256
|
4.4
|
49.0
|
1.0
|
C
|
C:SER255
|
4.5
|
47.5
|
1.0
|
OXT
|
C:LEU256
|
4.5
|
50.0
|
1.0
|
N
|
C:ILE90
|
4.5
|
52.0
|
1.0
|
OD2
|
C:ASP156
|
4.7
|
38.6
|
1.0
|
O
|
C:HOH1587
|
4.7
|
57.9
|
1.0
|
CA
|
C:SER255
|
4.8
|
47.1
|
1.0
|
CA
|
C:ALA253
|
4.8
|
42.2
|
1.0
|
CZ
|
C:ARG94
|
4.9
|
67.7
|
1.0
|
CB
|
C:LYS254
|
5.0
|
44.3
|
1.0
|
|
Sodium binding site 4 out
of 5 in 2ahr
Go back to
Sodium Binding Sites List in 2ahr
Sodium binding site 4 out
of 5 in the Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 4 of Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Na1260
b:37.0
occ:1.00
|
O
|
D:HOH1656
|
2.3
|
41.7
|
1.0
|
O
|
D:LEU256
|
2.3
|
41.9
|
1.0
|
O
|
D:GLY89
|
2.4
|
39.9
|
1.0
|
O
|
D:HOH1657
|
2.4
|
41.8
|
1.0
|
O
|
D:ALA253
|
2.5
|
35.0
|
1.0
|
O
|
D:LYS254
|
2.7
|
37.5
|
1.0
|
C
|
D:LYS254
|
3.3
|
37.5
|
1.0
|
NH2
|
D:ARG94
|
3.3
|
57.7
|
1.0
|
C
|
D:GLY89
|
3.3
|
40.0
|
1.0
|
C
|
D:LEU256
|
3.4
|
42.3
|
1.0
|
C
|
D:ALA253
|
3.5
|
34.2
|
1.0
|
CA
|
D:LYS254
|
3.5
|
36.7
|
1.0
|
O
|
D:HOH1646
|
3.6
|
72.8
|
1.0
|
CA
|
D:GLY89
|
3.6
|
39.6
|
1.0
|
O
|
D:HOH1625
|
3.7
|
62.4
|
1.0
|
N
|
D:LEU256
|
3.9
|
40.8
|
1.0
|
N
|
D:LYS254
|
4.0
|
35.2
|
1.0
|
CA
|
D:LEU256
|
4.1
|
41.5
|
1.0
|
O
|
D:HOH1624
|
4.2
|
65.5
|
1.0
|
N
|
D:SER255
|
4.2
|
37.6
|
1.0
|
OXT
|
D:LEU256
|
4.3
|
43.0
|
1.0
|
C
|
D:SER255
|
4.4
|
40.1
|
1.0
|
CB
|
D:LEU256
|
4.4
|
41.1
|
1.0
|
N
|
D:ILE90
|
4.6
|
40.3
|
1.0
|
CZ
|
D:ARG94
|
4.6
|
56.8
|
1.0
|
OD2
|
D:ASP156
|
4.8
|
38.4
|
1.0
|
CA
|
D:SER255
|
4.8
|
39.4
|
1.0
|
CA
|
D:ALA253
|
4.8
|
33.8
|
1.0
|
O
|
D:HOH1553
|
4.9
|
38.6
|
1.0
|
O
|
D:SER255
|
4.9
|
40.8
|
1.0
|
CB
|
D:LYS254
|
4.9
|
36.3
|
1.0
|
|
Sodium binding site 5 out
of 5 in 2ahr
Go back to
Sodium Binding Sites List in 2ahr
Sodium binding site 5 out
of 5 in the Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 5 of Crystal Structures of 1-Pyrroline-5-Carboxylate Reductase From Human Pathogen Streptococcus Pyogenes within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Na1261
b:40.5
occ:1.00
|
O
|
E:HOH1583
|
2.4
|
38.2
|
1.0
|
O
|
E:HOH1590
|
2.4
|
39.0
|
1.0
|
O
|
E:GLY89
|
2.4
|
41.2
|
1.0
|
O
|
E:LEU256
|
2.5
|
43.4
|
1.0
|
O
|
E:ALA253
|
2.5
|
35.9
|
1.0
|
O
|
E:LYS254
|
2.9
|
39.1
|
1.0
|
C
|
E:GLY89
|
3.3
|
41.0
|
1.0
|
C
|
E:LYS254
|
3.4
|
38.8
|
1.0
|
CA
|
E:GLY89
|
3.5
|
40.4
|
1.0
|
C
|
E:LEU256
|
3.6
|
43.4
|
1.0
|
CA
|
E:LYS254
|
3.6
|
37.6
|
1.0
|
C
|
E:ALA253
|
3.6
|
35.2
|
1.0
|
NH1
|
E:ARG94
|
3.6
|
53.9
|
1.0
|
O
|
E:HOH1593
|
3.9
|
50.4
|
1.0
|
N
|
E:LEU256
|
4.0
|
42.0
|
1.0
|
N
|
E:LYS254
|
4.0
|
36.1
|
1.0
|
CA
|
E:LEU256
|
4.2
|
42.7
|
1.0
|
N
|
E:SER255
|
4.3
|
39.3
|
1.0
|
O
|
E:HOH1531
|
4.4
|
52.5
|
1.0
|
O
|
E:HOH1588
|
4.4
|
61.4
|
1.0
|
C
|
E:SER255
|
4.5
|
41.1
|
1.0
|
CB
|
E:LEU256
|
4.5
|
42.6
|
1.0
|
OXT
|
E:LEU256
|
4.5
|
43.7
|
1.0
|
N
|
E:ILE90
|
4.6
|
41.6
|
1.0
|
OD2
|
E:ASP156
|
4.8
|
38.5
|
1.0
|
O
|
E:HOH1556
|
4.8
|
51.1
|
1.0
|
CA
|
E:ALA253
|
4.9
|
34.4
|
1.0
|
CZ
|
E:ARG94
|
4.9
|
53.9
|
1.0
|
CA
|
E:SER255
|
4.9
|
40.6
|
1.0
|
CB
|
E:LYS254
|
4.9
|
37.6
|
1.0
|
N
|
E:GLY89
|
4.9
|
39.8
|
1.0
|
O
|
E:SER255
|
5.0
|
41.4
|
1.0
|
|
Reference:
B.Nocek,
C.Chang,
H.Li,
L.Lezondra,
D.Holzle,
F.Collart,
A.Joachimiak.
Crystal Structures of Delta(1)-Pyrroline-5-Carboxylate Reductase From Human Pathogens Neisseria Meningitides and Streptococcus Pyogenes J.Mol.Biol. V. 354 91 2005.
ISSN: ISSN 0022-2836
PubMed: 16233902
DOI: 10.1016/J.JMB.2005.08.036
Page generated: Mon Oct 7 01:52:02 2024
|