Zinc in PDB 2oba: Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
Enzymatic activity of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
All present enzymatic activity of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase:
4.2.3.12;
Protein crystallography data
The structure of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase, PDB code: 2oba
was solved by
T.E.Mcgrath,
G.Kisselman,
K.Battaile,
V.Romanov,
J.Wu-Brown,
J.Guthrie,
C.Virag,
K.Mansoury,
A.M.Edwards,
E.F.Pai,
N.Y.Chirgadze,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
42.22 /
2.33
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
76.082,
87.521,
124.670,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
18.6 /
25.6
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
(pdb code 2oba). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 6 binding sites of Zinc where determined in the
Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase, PDB code: 2oba:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
Zinc binding site 1 out
of 6 in 2oba
Go back to
Zinc Binding Sites List in 2oba
Zinc binding site 1 out
of 6 in the Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn200
b:37.8
occ:1.00
|
O
|
A:HOH262
|
2.1
|
37.2
|
1.0
|
OE2
|
A:GLU107
|
2.1
|
52.5
|
1.0
|
NE2
|
A:HIS30
|
2.2
|
39.4
|
1.0
|
NE2
|
A:HIS28
|
2.4
|
42.1
|
1.0
|
NE2
|
A:HIS13
|
2.4
|
47.4
|
1.0
|
O
|
A:HOH257
|
2.5
|
33.4
|
1.0
|
CE1
|
A:HIS30
|
3.1
|
36.2
|
1.0
|
CD2
|
A:HIS28
|
3.2
|
39.5
|
1.0
|
CD2
|
A:HIS30
|
3.2
|
38.4
|
1.0
|
CD
|
A:GLU107
|
3.2
|
51.7
|
1.0
|
CE1
|
A:HIS13
|
3.3
|
42.8
|
1.0
|
CD2
|
A:HIS13
|
3.5
|
45.8
|
1.0
|
CE1
|
A:HIS28
|
3.6
|
43.1
|
1.0
|
CG
|
A:GLU107
|
3.8
|
48.0
|
1.0
|
O
|
A:HOH214
|
4.1
|
40.0
|
1.0
|
OE1
|
A:GLU107
|
4.2
|
51.4
|
1.0
|
ND1
|
A:HIS30
|
4.3
|
38.1
|
1.0
|
NE2
|
D:HIS68
|
4.3
|
39.5
|
1.0
|
CG
|
A:HIS30
|
4.3
|
39.1
|
1.0
|
CG
|
A:HIS28
|
4.4
|
41.8
|
1.0
|
ND1
|
A:HIS13
|
4.5
|
44.6
|
1.0
|
O
|
A:HOH261
|
4.5
|
47.8
|
1.0
|
ND1
|
A:HIS28
|
4.6
|
41.2
|
1.0
|
CG
|
A:HIS13
|
4.6
|
43.9
|
1.0
|
CD2
|
D:HIS68
|
4.8
|
42.3
|
1.0
|
|
Zinc binding site 2 out
of 6 in 2oba
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Zinc Binding Sites List in 2oba
Zinc binding site 2 out
of 6 in the Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn200
b:54.1
occ:1.00
|
OE2
|
B:GLU107
|
2.1
|
53.3
|
1.0
|
NE2
|
B:HIS28
|
2.1
|
40.0
|
1.0
|
NE2
|
B:HIS30
|
2.3
|
37.9
|
1.0
|
NE2
|
B:HIS13
|
2.4
|
39.7
|
1.0
|
O
|
F:HOH214
|
2.6
|
47.2
|
1.0
|
CE1
|
B:HIS28
|
3.1
|
37.6
|
1.0
|
CD2
|
B:HIS28
|
3.2
|
39.0
|
1.0
|
CD
|
B:GLU107
|
3.2
|
50.6
|
1.0
|
CE1
|
B:HIS13
|
3.2
|
40.4
|
1.0
|
CE1
|
B:HIS30
|
3.2
|
37.7
|
1.0
|
CD2
|
B:HIS30
|
3.3
|
37.3
|
1.0
|
CD2
|
B:HIS13
|
3.4
|
40.3
|
1.0
|
CG
|
B:GLU107
|
3.9
|
49.7
|
1.0
|
OE1
|
B:GLU107
|
4.1
|
56.6
|
1.0
|
ND1
|
B:HIS28
|
4.2
|
37.7
|
1.0
|
CG
|
B:HIS28
|
4.3
|
37.9
|
1.0
|
ND1
|
B:HIS30
|
4.4
|
38.8
|
1.0
|
ND1
|
B:HIS13
|
4.4
|
40.9
|
1.0
|
CG
|
B:HIS30
|
4.4
|
38.6
|
1.0
|
NE2
|
F:HIS68
|
4.5
|
37.0
|
1.0
|
CG
|
B:HIS13
|
4.5
|
41.5
|
1.0
|
SG
|
B:CYS24
|
4.5
|
51.4
|
1.0
|
CD2
|
F:HIS68
|
4.8
|
38.5
|
1.0
|
|
Zinc binding site 3 out
of 6 in 2oba
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Zinc Binding Sites List in 2oba
Zinc binding site 3 out
of 6 in the Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn200
b:50.9
occ:1.00
|
NE2
|
C:HIS30
|
2.2
|
39.5
|
1.0
|
NE2
|
C:HIS13
|
2.3
|
40.1
|
1.0
|
NE2
|
C:HIS28
|
2.3
|
35.0
|
1.0
|
OE1
|
C:GLU107
|
3.1
|
57.8
|
1.0
|
CE1
|
C:HIS13
|
3.1
|
39.7
|
1.0
|
CE1
|
C:HIS30
|
3.2
|
37.3
|
1.0
|
CD2
|
C:HIS30
|
3.2
|
36.9
|
1.0
|
CD2
|
C:HIS28
|
3.3
|
37.2
|
1.0
|
CE1
|
C:HIS28
|
3.3
|
37.1
|
1.0
|
CD2
|
C:HIS13
|
3.4
|
40.0
|
1.0
|
CD
|
C:GLU107
|
3.9
|
59.0
|
1.0
|
OE2
|
C:GLU107
|
4.0
|
60.2
|
1.0
|
SG
|
C:CYS24
|
4.2
|
51.2
|
1.0
|
ND1
|
C:HIS30
|
4.3
|
39.0
|
1.0
|
ND1
|
C:HIS13
|
4.3
|
41.9
|
1.0
|
CG
|
C:HIS30
|
4.4
|
37.7
|
1.0
|
NE2
|
E:HIS68
|
4.4
|
42.8
|
1.0
|
ND1
|
C:HIS28
|
4.4
|
39.2
|
1.0
|
CG
|
C:HIS28
|
4.4
|
40.1
|
1.0
|
CG
|
C:HIS13
|
4.5
|
40.7
|
1.0
|
CD2
|
E:HIS68
|
4.8
|
41.6
|
1.0
|
CB
|
C:CYS24
|
4.9
|
47.5
|
1.0
|
|
Zinc binding site 4 out
of 6 in 2oba
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Zinc Binding Sites List in 2oba
Zinc binding site 4 out
of 6 in the Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn200
b:42.4
occ:1.00
|
NE2
|
D:HIS30
|
2.2
|
42.0
|
1.0
|
NE2
|
D:HIS28
|
2.2
|
40.5
|
1.0
|
NE2
|
D:HIS13
|
2.4
|
42.7
|
1.0
|
OE2
|
D:GLU107
|
2.5
|
54.3
|
1.0
|
CE1
|
D:HIS30
|
3.1
|
40.0
|
1.0
|
CD2
|
D:HIS28
|
3.2
|
40.6
|
1.0
|
CE1
|
D:HIS28
|
3.2
|
42.9
|
1.0
|
CD2
|
D:HIS30
|
3.3
|
40.3
|
1.0
|
CE1
|
D:HIS13
|
3.3
|
36.7
|
1.0
|
CD2
|
D:HIS13
|
3.4
|
39.7
|
1.0
|
CD
|
D:GLU107
|
3.4
|
52.6
|
1.0
|
CG
|
D:GLU107
|
4.1
|
50.8
|
1.0
|
OE1
|
D:GLU107
|
4.2
|
53.9
|
1.0
|
ND1
|
D:HIS30
|
4.3
|
41.4
|
1.0
|
SG
|
D:CYS24
|
4.3
|
51.4
|
1.0
|
ND1
|
D:HIS28
|
4.4
|
43.6
|
1.0
|
CG
|
D:HIS28
|
4.4
|
43.9
|
1.0
|
CG
|
D:HIS30
|
4.4
|
39.8
|
1.0
|
NE2
|
A:HIS68
|
4.4
|
40.2
|
1.0
|
ND1
|
D:HIS13
|
4.4
|
41.5
|
1.0
|
CG
|
D:HIS13
|
4.5
|
39.8
|
1.0
|
CD2
|
A:HIS68
|
4.9
|
39.6
|
1.0
|
O
|
F:HOH236
|
4.9
|
36.5
|
1.0
|
|
Zinc binding site 5 out
of 6 in 2oba
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Zinc Binding Sites List in 2oba
Zinc binding site 5 out
of 6 in the Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Zn200
b:54.0
occ:1.00
|
NE2
|
E:HIS28
|
2.3
|
44.5
|
1.0
|
NE2
|
E:HIS30
|
2.4
|
38.9
|
1.0
|
OE2
|
E:GLU107
|
2.5
|
57.2
|
1.0
|
NE2
|
E:HIS13
|
2.5
|
45.5
|
1.0
|
O
|
C:HOH220
|
2.5
|
44.5
|
1.0
|
CE1
|
E:HIS30
|
3.3
|
37.7
|
1.0
|
CD2
|
E:HIS28
|
3.3
|
44.7
|
1.0
|
CE1
|
E:HIS28
|
3.3
|
44.8
|
1.0
|
CE1
|
E:HIS13
|
3.4
|
42.1
|
1.0
|
CD2
|
E:HIS13
|
3.4
|
43.8
|
1.0
|
CD2
|
E:HIS30
|
3.5
|
40.2
|
1.0
|
CD
|
E:GLU107
|
3.5
|
53.9
|
1.0
|
CG
|
E:GLU107
|
4.0
|
48.6
|
1.0
|
O
|
C:HOH242
|
4.2
|
51.5
|
1.0
|
ND1
|
E:HIS28
|
4.4
|
44.6
|
1.0
|
CG
|
E:HIS28
|
4.4
|
42.4
|
1.0
|
ND1
|
E:HIS30
|
4.4
|
37.7
|
1.0
|
OE1
|
E:GLU107
|
4.5
|
56.3
|
1.0
|
ND1
|
E:HIS13
|
4.5
|
44.2
|
1.0
|
NE2
|
C:HIS68
|
4.5
|
43.2
|
1.0
|
CG
|
E:HIS30
|
4.6
|
39.9
|
1.0
|
CG
|
E:HIS13
|
4.6
|
43.3
|
1.0
|
CD2
|
C:HIS68
|
4.8
|
41.5
|
1.0
|
SG
|
E:CYS24
|
5.0
|
49.6
|
1.0
|
|
Zinc binding site 6 out
of 6 in 2oba
Go back to
Zinc Binding Sites List in 2oba
Zinc binding site 6 out
of 6 in the Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Zn200
b:56.8
occ:1.00
|
NE2
|
F:HIS30
|
2.3
|
41.9
|
1.0
|
NE2
|
F:HIS28
|
2.3
|
39.4
|
1.0
|
NE2
|
F:HIS13
|
2.5
|
42.0
|
1.0
|
OE1
|
F:GLU107
|
3.1
|
55.9
|
1.0
|
CE1
|
F:HIS28
|
3.2
|
38.8
|
1.0
|
CD2
|
F:HIS30
|
3.3
|
40.0
|
1.0
|
CE1
|
F:HIS30
|
3.3
|
40.7
|
1.0
|
CE1
|
F:HIS13
|
3.3
|
40.6
|
1.0
|
CD2
|
F:HIS28
|
3.4
|
36.5
|
1.0
|
CD2
|
F:HIS13
|
3.5
|
42.7
|
1.0
|
CD
|
F:GLU107
|
3.9
|
51.8
|
1.0
|
OE2
|
F:GLU107
|
4.1
|
55.4
|
1.0
|
NE2
|
B:HIS68
|
4.3
|
44.0
|
1.0
|
ND1
|
F:HIS28
|
4.3
|
38.2
|
1.0
|
ND1
|
F:HIS30
|
4.4
|
40.3
|
1.0
|
CG
|
F:HIS30
|
4.4
|
41.1
|
1.0
|
CG
|
F:HIS28
|
4.5
|
40.3
|
1.0
|
ND1
|
F:HIS13
|
4.5
|
42.6
|
1.0
|
CG
|
F:HIS13
|
4.6
|
43.1
|
1.0
|
CD2
|
B:HIS68
|
4.9
|
42.7
|
1.0
|
SG
|
F:CYS24
|
4.9
|
51.0
|
1.0
|
|
Reference:
T.E.Mcgrath,
G.Kisselman,
K.Battaile,
V.Romanov,
J.Wu-Brown,
J.Guthrie,
C.Virag,
K.Mansoury,
A.M.Edwards,
E.F.Pai,
N.Y.Chirgadze.
Pseudomonas Aeruginosa 6-Pyruvoyl Tetrahydrobiopterin Synthase To Be Published.
Page generated: Thu Oct 17 02:32:59 2024
|