Iron in PDB 1xik: Ribonucleoside-Diphosphate Reductase 1 Beta Chain
Enzymatic activity of Ribonucleoside-Diphosphate Reductase 1 Beta Chain
All present enzymatic activity of Ribonucleoside-Diphosphate Reductase 1 Beta Chain:
1.17.4.1;
Protein crystallography data
The structure of Ribonucleoside-Diphosphate Reductase 1 Beta Chain, PDB code: 1xik
was solved by
D.T.Logan,
X.-D.Su,
A.Aberg,
K.Regnstrom,
J.Hajdu,
H.Eklund,
P.Nordlund,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
15.00 /
1.70
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
73.440,
83.530,
113.700,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
20.6 /
28
|
Other elements in 1xik:
The structure of Ribonucleoside-Diphosphate Reductase 1 Beta Chain also contains other interesting chemical elements:
Iron Binding Sites:
The binding sites of Iron atom in the Ribonucleoside-Diphosphate Reductase 1 Beta Chain
(pdb code 1xik). This binding sites where shown within
5.0 Angstroms radius around Iron atom.
In total 4 binding sites of Iron where determined in the
Ribonucleoside-Diphosphate Reductase 1 Beta Chain, PDB code: 1xik:
Jump to Iron binding site number:
1;
2;
3;
4;
Iron binding site 1 out
of 4 in 1xik
Go back to
Iron Binding Sites List in 1xik
Iron binding site 1 out
of 4 in the Ribonucleoside-Diphosphate Reductase 1 Beta Chain
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 1 of Ribonucleoside-Diphosphate Reductase 1 Beta Chain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe376
b:17.0
occ:1.00
|
OD1
|
A:ASP84
|
1.7
|
20.6
|
1.0
|
OE2
|
A:GLU238
|
1.7
|
29.7
|
1.0
|
OE1
|
A:GLU115
|
2.0
|
24.4
|
1.0
|
ND1
|
A:HIS118
|
2.0
|
18.2
|
1.0
|
CG
|
A:ASP84
|
2.5
|
20.9
|
1.0
|
OD2
|
A:ASP84
|
2.7
|
21.6
|
1.0
|
CD
|
A:GLU238
|
2.8
|
36.0
|
1.0
|
CE1
|
A:HIS118
|
2.8
|
18.2
|
1.0
|
CD
|
A:GLU115
|
3.1
|
28.3
|
1.0
|
CG
|
A:HIS118
|
3.1
|
17.4
|
1.0
|
OE1
|
A:GLU238
|
3.4
|
25.3
|
1.0
|
CZ
|
A:PHE208
|
3.6
|
31.0
|
1.0
|
CB
|
A:HIS118
|
3.6
|
15.6
|
1.0
|
OE2
|
A:GLU115
|
3.7
|
23.3
|
1.0
|
FE
|
A:FE2377
|
3.9
|
19.7
|
1.0
|
CB
|
A:ASP84
|
4.0
|
18.9
|
1.0
|
NE2
|
A:HIS118
|
4.0
|
18.4
|
1.0
|
CE2
|
A:PHE208
|
4.1
|
32.9
|
1.0
|
CG
|
A:GLU238
|
4.1
|
27.8
|
1.0
|
CE1
|
A:PHE208
|
4.1
|
31.6
|
1.0
|
CD2
|
A:HIS118
|
4.2
|
18.4
|
1.0
|
CA
|
A:GLU115
|
4.2
|
15.6
|
1.0
|
CG
|
A:GLU115
|
4.3
|
18.1
|
1.0
|
CB
|
A:GLU115
|
4.3
|
16.2
|
1.0
|
CG2
|
A:ILE234
|
4.3
|
18.4
|
1.0
|
CA
|
A:ASP84
|
4.8
|
18.1
|
1.0
|
OH
|
A:TYR122
|
4.8
|
27.4
|
1.0
|
O
|
A:GLU115
|
4.9
|
19.0
|
1.0
|
CE1
|
A:HIS241
|
4.9
|
23.1
|
1.0
|
ND1
|
A:HIS241
|
4.9
|
23.4
|
1.0
|
CD2
|
A:PHE208
|
5.0
|
29.6
|
1.0
|
|
Iron binding site 2 out
of 4 in 1xik
Go back to
Iron Binding Sites List in 1xik
Iron binding site 2 out
of 4 in the Ribonucleoside-Diphosphate Reductase 1 Beta Chain
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 2 of Ribonucleoside-Diphosphate Reductase 1 Beta Chain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe377
b:19.7
occ:1.00
|
OE1
|
A:GLU238
|
1.8
|
25.3
|
1.0
|
OE2
|
A:GLU115
|
2.0
|
23.3
|
1.0
|
ND1
|
A:HIS241
|
2.0
|
23.4
|
1.0
|
OE1
|
A:GLU204
|
2.2
|
25.4
|
1.0
|
CD
|
A:GLU115
|
2.8
|
28.3
|
1.0
|
CD
|
A:GLU204
|
2.9
|
40.7
|
1.0
|
CD
|
A:GLU238
|
2.9
|
36.0
|
1.0
|
OE2
|
A:GLU204
|
2.9
|
29.8
|
1.0
|
OE1
|
A:GLU115
|
3.0
|
24.4
|
1.0
|
CE1
|
A:HIS241
|
3.0
|
23.1
|
1.0
|
CG
|
A:HIS241
|
3.0
|
21.6
|
1.0
|
CB
|
A:HIS241
|
3.4
|
17.9
|
1.0
|
OE2
|
A:GLU238
|
3.5
|
29.7
|
1.0
|
NE1
|
A:TRP111
|
3.7
|
21.2
|
1.0
|
FE
|
A:FE2376
|
3.9
|
17.0
|
1.0
|
CE2
|
A:PHE208
|
4.0
|
32.9
|
1.0
|
CG
|
A:GLU115
|
4.1
|
18.1
|
1.0
|
NE2
|
A:HIS241
|
4.1
|
23.3
|
1.0
|
CG
|
A:GLU238
|
4.1
|
27.8
|
1.0
|
CA
|
A:GLU238
|
4.1
|
20.4
|
1.0
|
CD2
|
A:HIS241
|
4.2
|
23.7
|
1.0
|
CD1
|
A:TRP111
|
4.2
|
21.6
|
1.0
|
CB
|
A:GLU238
|
4.2
|
21.1
|
1.0
|
CG
|
A:GLU204
|
4.3
|
32.0
|
1.0
|
CD2
|
A:PHE208
|
4.7
|
29.6
|
1.0
|
OD1
|
A:ASP84
|
4.7
|
20.6
|
1.0
|
CZ
|
A:PHE208
|
4.8
|
31.0
|
1.0
|
CB
|
A:GLU204
|
4.8
|
25.5
|
1.0
|
CE2
|
A:TRP111
|
4.9
|
22.1
|
1.0
|
N
|
A:GLU238
|
4.9
|
21.3
|
1.0
|
CA
|
A:HIS241
|
4.9
|
17.2
|
1.0
|
O
|
A:GLU238
|
5.0
|
22.9
|
1.0
|
CE1
|
A:HIS118
|
5.0
|
18.2
|
1.0
|
|
Iron binding site 3 out
of 4 in 1xik
Go back to
Iron Binding Sites List in 1xik
Iron binding site 3 out
of 4 in the Ribonucleoside-Diphosphate Reductase 1 Beta Chain
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 3 of Ribonucleoside-Diphosphate Reductase 1 Beta Chain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Fe376
b:20.9
occ:1.00
|
OE2
|
B:GLU238
|
1.8
|
45.2
|
1.0
|
OD1
|
B:ASP84
|
2.0
|
24.3
|
1.0
|
ND1
|
B:HIS118
|
2.1
|
16.3
|
1.0
|
OE1
|
B:GLU115
|
2.2
|
21.2
|
1.0
|
CG
|
B:ASP84
|
2.7
|
22.4
|
1.0
|
OD2
|
B:ASP84
|
2.7
|
27.6
|
1.0
|
CE1
|
B:HIS118
|
2.8
|
15.7
|
1.0
|
CD
|
B:GLU238
|
2.9
|
40.5
|
1.0
|
CD
|
B:GLU115
|
3.1
|
27.9
|
1.0
|
CG
|
B:HIS118
|
3.2
|
15.3
|
1.0
|
OE1
|
B:GLU238
|
3.3
|
30.7
|
1.0
|
CZ
|
B:PHE208
|
3.5
|
29.6
|
1.0
|
OE2
|
B:GLU115
|
3.7
|
28.2
|
1.0
|
CB
|
B:HIS118
|
3.8
|
14.0
|
1.0
|
FE
|
B:FE2377
|
3.9
|
26.2
|
1.0
|
CE2
|
B:PHE208
|
3.9
|
32.3
|
1.0
|
NE2
|
B:HIS118
|
4.1
|
16.2
|
1.0
|
CB
|
B:ASP84
|
4.1
|
16.5
|
1.0
|
CG
|
B:GLU238
|
4.2
|
28.4
|
1.0
|
CE1
|
B:PHE208
|
4.2
|
30.5
|
1.0
|
CD2
|
B:HIS118
|
4.3
|
16.6
|
1.0
|
CA
|
B:GLU115
|
4.3
|
12.9
|
1.0
|
CG
|
B:GLU115
|
4.3
|
15.1
|
1.0
|
CB
|
B:GLU115
|
4.3
|
13.5
|
1.0
|
CG2
|
B:ILE234
|
4.4
|
16.7
|
1.0
|
CE1
|
B:HIS241
|
4.7
|
14.7
|
1.0
|
CA
|
B:ASP84
|
4.8
|
15.3
|
1.0
|
ND1
|
B:HIS241
|
4.8
|
15.5
|
1.0
|
CD2
|
B:PHE208
|
4.9
|
29.7
|
1.0
|
O
|
B:GLU115
|
4.9
|
18.8
|
1.0
|
OH
|
B:TYR122
|
4.9
|
26.3
|
1.0
|
|
Iron binding site 4 out
of 4 in 1xik
Go back to
Iron Binding Sites List in 1xik
Iron binding site 4 out
of 4 in the Ribonucleoside-Diphosphate Reductase 1 Beta Chain
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 4 of Ribonucleoside-Diphosphate Reductase 1 Beta Chain within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Fe377
b:26.2
occ:1.00
|
OE1
|
B:GLU238
|
1.8
|
30.7
|
1.0
|
ND1
|
B:HIS241
|
2.0
|
15.5
|
1.0
|
OE2
|
B:GLU115
|
2.1
|
28.2
|
1.0
|
OE1
|
B:GLU204
|
2.4
|
45.2
|
1.0
|
OE2
|
B:GLU204
|
2.5
|
32.6
|
1.0
|
CD
|
B:GLU204
|
2.8
|
35.4
|
1.0
|
CD
|
B:GLU115
|
2.8
|
27.9
|
1.0
|
CD
|
B:GLU238
|
3.0
|
40.5
|
1.0
|
OE1
|
B:GLU115
|
3.0
|
21.2
|
1.0
|
CE1
|
B:HIS241
|
3.0
|
14.7
|
1.0
|
CG
|
B:HIS241
|
3.0
|
14.8
|
1.0
|
CB
|
B:HIS241
|
3.4
|
13.1
|
1.0
|
OE2
|
B:GLU238
|
3.5
|
45.2
|
1.0
|
NE1
|
B:TRP111
|
3.7
|
18.2
|
1.0
|
FE
|
B:FE2376
|
3.9
|
20.9
|
1.0
|
NE2
|
B:HIS241
|
4.1
|
14.6
|
1.0
|
CD2
|
B:HIS241
|
4.2
|
15.2
|
1.0
|
CG
|
B:GLU238
|
4.2
|
28.4
|
1.0
|
CD1
|
B:TRP111
|
4.2
|
18.7
|
1.0
|
CG
|
B:GLU115
|
4.3
|
15.1
|
1.0
|
CA
|
B:GLU238
|
4.3
|
17.5
|
1.0
|
CG
|
B:GLU204
|
4.3
|
29.5
|
1.0
|
CB
|
B:GLU238
|
4.4
|
18.6
|
1.0
|
CE2
|
B:PHE208
|
4.4
|
32.3
|
1.0
|
CE2
|
B:TRP111
|
4.8
|
19.4
|
1.0
|
CD2
|
B:PHE208
|
4.8
|
29.7
|
1.0
|
OD1
|
B:ASP84
|
4.9
|
24.3
|
1.0
|
CA
|
B:HIS241
|
4.9
|
13.3
|
1.0
|
N
|
B:GLU238
|
4.9
|
18.6
|
1.0
|
|
Reference:
D.T.Logan,
X.D.Su,
A.Aberg,
K.Regnstrom,
J.Hajdu,
H.Eklund,
P.Nordlund.
Crystal Structure of Reduced Protein R2 of Ribonucleotide Reductase: the Structural Basis For Oxygen Activation at A Dinuclear Iron Site. Structure V. 4 1053 1996.
ISSN: ISSN 0969-2126
PubMed: 8805591
DOI: 10.1016/S0969-2126(96)00112-8
Page generated: Sat Aug 3 16:52:17 2024
|