Iron in PDB 1vk2: Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution
Protein crystallography data
The structure of Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution, PDB code: 1vk2
was solved by
Joint Center For Structural Genomics (Jcsg),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
44.09 /
1.90
|
Space group
|
P 43 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
61.049,
61.049,
127.500,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
17.7 /
20.6
|
Iron Binding Sites:
The binding sites of Iron atom in the Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution
(pdb code 1vk2). This binding sites where shown within
5.0 Angstroms radius around Iron atom.
In total 4 binding sites of Iron where determined in the
Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution, PDB code: 1vk2:
Jump to Iron binding site number:
1;
2;
3;
4;
Iron binding site 1 out
of 4 in 1vk2
Go back to
Iron Binding Sites List in 1vk2
Iron binding site 1 out
of 4 in the Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 1 of Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe201
b:20.4
occ:0.80
|
FE1
|
A:SF4201
|
0.0
|
20.4
|
0.8
|
SG
|
A:CYS105
|
2.2
|
24.1
|
1.0
|
S4
|
A:SF4201
|
2.3
|
20.5
|
0.8
|
S2
|
A:SF4201
|
2.3
|
21.7
|
0.8
|
S3
|
A:SF4201
|
2.4
|
22.4
|
0.8
|
FE2
|
A:SF4201
|
2.7
|
20.5
|
0.8
|
FE4
|
A:SF4201
|
2.7
|
20.0
|
0.8
|
FE3
|
A:SF4201
|
2.7
|
19.3
|
0.8
|
CB
|
A:CYS105
|
3.1
|
20.6
|
1.0
|
CA
|
A:CYS105
|
3.7
|
22.7
|
1.0
|
S1
|
A:SF4201
|
3.9
|
20.8
|
0.8
|
CB
|
A:LYS88
|
4.2
|
24.4
|
1.0
|
N
|
A:LYS88
|
4.2
|
18.8
|
1.0
|
CD2
|
A:PHE108
|
4.5
|
24.9
|
1.0
|
N
|
A:CYS105
|
4.5
|
22.6
|
1.0
|
CE2
|
A:PHE108
|
4.6
|
23.0
|
1.0
|
SG
|
A:CYS18
|
4.7
|
25.8
|
1.0
|
SG
|
A:CYS21
|
4.7
|
24.1
|
1.0
|
SG
|
A:CYS89
|
4.8
|
26.1
|
1.0
|
O
|
A:HOH397
|
4.8
|
55.5
|
1.0
|
CA
|
A:LYS88
|
4.8
|
21.7
|
1.0
|
C
|
A:CYS105
|
4.9
|
24.8
|
1.0
|
N
|
A:CYS89
|
4.9
|
23.7
|
1.0
|
O
|
A:CYS105
|
5.0
|
25.1
|
1.0
|
|
Iron binding site 2 out
of 4 in 1vk2
Go back to
Iron Binding Sites List in 1vk2
Iron binding site 2 out
of 4 in the Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 2 of Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe201
b:20.5
occ:0.80
|
FE2
|
A:SF4201
|
0.0
|
20.5
|
0.8
|
S1
|
A:SF4201
|
2.3
|
20.8
|
0.8
|
S4
|
A:SF4201
|
2.3
|
20.5
|
0.8
|
S3
|
A:SF4201
|
2.3
|
22.4
|
0.8
|
SG
|
A:CYS18
|
2.4
|
25.8
|
1.0
|
FE1
|
A:SF4201
|
2.7
|
20.4
|
0.8
|
FE4
|
A:SF4201
|
2.7
|
20.0
|
0.8
|
FE3
|
A:SF4201
|
2.7
|
19.3
|
0.8
|
CB
|
A:CYS18
|
3.2
|
27.3
|
1.0
|
O
|
A:HOH397
|
3.9
|
55.5
|
1.0
|
S2
|
A:SF4201
|
3.9
|
21.7
|
0.8
|
N
|
A:ALA20
|
4.1
|
28.0
|
1.0
|
O
|
A:CYS18
|
4.2
|
27.6
|
1.0
|
C
|
A:CYS18
|
4.2
|
26.9
|
1.0
|
CA
|
A:CYS18
|
4.3
|
26.3
|
1.0
|
CE2
|
A:PHE108
|
4.4
|
23.0
|
1.0
|
CB
|
A:ALA20
|
4.5
|
29.3
|
1.0
|
N
|
A:CYS21
|
4.5
|
30.2
|
1.0
|
N
|
A:THR19
|
4.6
|
28.4
|
1.0
|
O
|
A:HOH334
|
4.6
|
38.4
|
1.0
|
SG
|
A:CYS105
|
4.7
|
24.1
|
1.0
|
CA
|
A:ALA20
|
4.7
|
30.1
|
1.0
|
SG
|
A:CYS21
|
4.8
|
24.1
|
1.0
|
C
|
A:THR19
|
4.9
|
30.3
|
1.0
|
SG
|
A:CYS89
|
4.9
|
26.1
|
1.0
|
CA
|
A:THR19
|
5.0
|
29.6
|
1.0
|
|
Iron binding site 3 out
of 4 in 1vk2
Go back to
Iron Binding Sites List in 1vk2
Iron binding site 3 out
of 4 in the Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 3 of Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe201
b:19.3
occ:0.80
|
FE3
|
A:SF4201
|
0.0
|
19.3
|
0.8
|
S4
|
A:SF4201
|
2.3
|
20.5
|
0.8
|
S2
|
A:SF4201
|
2.3
|
21.7
|
0.8
|
SG
|
A:CYS89
|
2.3
|
26.1
|
1.0
|
S1
|
A:SF4201
|
2.4
|
20.8
|
0.8
|
FE2
|
A:SF4201
|
2.7
|
20.5
|
0.8
|
FE1
|
A:SF4201
|
2.7
|
20.4
|
0.8
|
FE4
|
A:SF4201
|
2.7
|
20.0
|
0.8
|
CB
|
A:CYS89
|
3.3
|
26.3
|
1.0
|
O
|
A:HOH334
|
4.0
|
38.4
|
1.0
|
S3
|
A:SF4201
|
4.0
|
22.4
|
0.8
|
N
|
A:CYS89
|
4.0
|
23.7
|
1.0
|
CA
|
A:CYS89
|
4.3
|
21.6
|
1.0
|
N
|
A:HIS24
|
4.5
|
25.9
|
1.0
|
CB
|
A:LYS88
|
4.5
|
24.4
|
1.0
|
CB
|
A:LEU23
|
4.6
|
24.5
|
1.0
|
C
|
A:LYS88
|
4.6
|
23.1
|
1.0
|
SG
|
A:CYS21
|
4.6
|
24.1
|
1.0
|
SG
|
A:CYS105
|
4.7
|
24.1
|
1.0
|
CA
|
A:HIS24
|
4.7
|
27.6
|
1.0
|
CB
|
A:HIS24
|
4.8
|
31.1
|
1.0
|
C
|
A:LEU23
|
4.9
|
25.2
|
1.0
|
O
|
A:CYS18
|
4.9
|
27.6
|
1.0
|
SG
|
A:CYS18
|
4.9
|
25.8
|
1.0
|
CB
|
A:CYS18
|
4.9
|
27.3
|
1.0
|
CA
|
A:LYS88
|
5.0
|
21.7
|
1.0
|
N
|
A:LYS88
|
5.0
|
18.8
|
1.0
|
|
Iron binding site 4 out
of 4 in 1vk2
Go back to
Iron Binding Sites List in 1vk2
Iron binding site 4 out
of 4 in the Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 4 of Crystal Structure of Uracil-Dna Glycosylase (TM0511) From Thermotoga Maritima at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe201
b:20.0
occ:0.80
|
FE4
|
A:SF4201
|
0.0
|
20.0
|
0.8
|
SG
|
A:CYS21
|
2.3
|
24.1
|
1.0
|
S3
|
A:SF4201
|
2.3
|
22.4
|
0.8
|
S1
|
A:SF4201
|
2.3
|
20.8
|
0.8
|
S2
|
A:SF4201
|
2.3
|
21.7
|
0.8
|
FE2
|
A:SF4201
|
2.7
|
20.5
|
0.8
|
FE1
|
A:SF4201
|
2.7
|
20.4
|
0.8
|
FE3
|
A:SF4201
|
2.7
|
19.3
|
0.8
|
CB
|
A:CYS21
|
3.3
|
28.9
|
1.0
|
N
|
A:CYS21
|
3.8
|
30.2
|
1.0
|
S4
|
A:SF4201
|
3.9
|
20.5
|
0.8
|
CA
|
A:CYS21
|
4.0
|
29.5
|
1.0
|
CB
|
A:LEU23
|
4.3
|
24.5
|
1.0
|
O
|
A:CYS21
|
4.3
|
27.3
|
1.0
|
C
|
A:CYS21
|
4.3
|
29.0
|
1.0
|
CB
|
A:CYS105
|
4.7
|
20.6
|
1.0
|
SG
|
A:CYS105
|
4.7
|
24.1
|
1.0
|
C
|
A:ALA20
|
4.7
|
31.7
|
1.0
|
N
|
A:LEU23
|
4.8
|
25.3
|
1.0
|
N
|
A:HIS24
|
4.8
|
25.9
|
1.0
|
SG
|
A:CYS89
|
4.8
|
26.1
|
1.0
|
CG
|
A:LEU23
|
4.8
|
20.9
|
1.0
|
SG
|
A:CYS18
|
4.9
|
25.8
|
1.0
|
CD1
|
A:LEU23
|
4.9
|
25.3
|
1.0
|
CA
|
A:LEU23
|
5.0
|
25.0
|
1.0
|
|
Reference:
Joint Center For Structural Genomics (Jcsg),
Joint Center For Structural Genomics (Jcsg).
N/A N/A.
Page generated: Sat Aug 3 16:14:27 2024
|