Iron in PDB 5cnv: Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution
Enzymatic activity of Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution
All present enzymatic activity of Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution:
1.17.4.1;
Protein crystallography data
The structure of Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution, PDB code: 5cnv
was solved by
P.Y.-T.Chen,
C.M.Zimanyi,
M.A.Funk,
C.L.Drennan,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
49.73 /
3.20
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
274.776,
157.753,
165.768,
90.00,
119.49,
90.00
|
R / Rfree (%)
|
19 /
21.9
|
Other elements in 5cnv:
The structure of Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution also contains other interesting chemical elements:
Iron Binding Sites:
The binding sites of Iron atom in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution
(pdb code 5cnv). This binding sites where shown within
5.0 Angstroms radius around Iron atom.
In total 8 binding sites of Iron where determined in the
Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution, PDB code: 5cnv:
Jump to Iron binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Iron binding site 1 out
of 8 in 5cnv
Go back to
Iron Binding Sites List in 5cnv
Iron binding site 1 out
of 8 in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms 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 the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Fe501
b:81.3
occ:1.00
|
FE1
|
E:FEO501
|
0.0
|
81.3
|
1.0
|
O
|
E:FEO501
|
1.8
|
75.4
|
1.0
|
O
|
E:HOH601
|
2.0
|
75.9
|
1.0
|
OE1
|
E:GLU115
|
2.1
|
75.1
|
1.0
|
OD1
|
E:ASP84
|
2.1
|
77.7
|
1.0
|
OD2
|
E:ASP84
|
2.1
|
76.8
|
1.0
|
ND1
|
E:HIS118
|
2.3
|
72.9
|
1.0
|
CG
|
E:ASP84
|
2.4
|
77.6
|
1.0
|
CE1
|
E:HIS118
|
3.1
|
73.1
|
1.0
|
FE2
|
E:FEO501
|
3.2
|
73.5
|
1.0
|
CD
|
E:GLU115
|
3.2
|
74.0
|
1.0
|
OE1
|
E:GLU238
|
3.2
|
74.7
|
1.0
|
O
|
E:HOH603
|
3.2
|
77.5
|
1.0
|
CG
|
E:HIS118
|
3.5
|
72.8
|
1.0
|
OE2
|
E:GLU115
|
3.6
|
74.3
|
1.0
|
CB
|
E:ASP84
|
3.9
|
77.0
|
1.0
|
CB
|
E:HIS118
|
3.9
|
72.8
|
1.0
|
CZ
|
E:PHE208
|
4.2
|
79.0
|
1.0
|
CE2
|
E:PHE208
|
4.3
|
79.2
|
1.0
|
CG2
|
E:ILE234
|
4.3
|
72.4
|
1.0
|
NE2
|
E:HIS118
|
4.3
|
72.2
|
1.0
|
CD
|
E:GLU238
|
4.4
|
75.2
|
1.0
|
CG
|
E:GLU115
|
4.5
|
71.9
|
1.0
|
CD2
|
E:HIS118
|
4.5
|
72.0
|
1.0
|
CE1
|
E:HIS241
|
4.6
|
73.1
|
1.0
|
CA
|
E:GLU115
|
4.6
|
71.2
|
1.0
|
CB
|
E:GLU115
|
4.7
|
72.0
|
1.0
|
CA
|
E:ASP84
|
4.7
|
78.7
|
1.0
|
ND1
|
E:HIS241
|
4.7
|
72.8
|
1.0
|
OH
|
E:TYR122
|
4.9
|
76.1
|
1.0
|
CE1
|
E:PHE208
|
4.9
|
77.9
|
1.0
|
CD2
|
E:PHE208
|
5.0
|
79.3
|
1.0
|
|
Iron binding site 2 out
of 8 in 5cnv
Go back to
Iron Binding Sites List in 5cnv
Iron binding site 2 out
of 8 in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms 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 the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Fe501
b:73.5
occ:1.00
|
FE2
|
E:FEO501
|
0.0
|
73.5
|
1.0
|
O
|
E:FEO501
|
1.8
|
75.4
|
1.0
|
O
|
E:HOH603
|
2.0
|
77.5
|
1.0
|
OE2
|
E:GLU115
|
2.0
|
74.3
|
1.0
|
OE1
|
E:GLU238
|
2.1
|
74.7
|
1.0
|
OE1
|
E:GLU204
|
2.1
|
75.0
|
1.0
|
ND1
|
E:HIS241
|
2.2
|
72.8
|
1.0
|
OE2
|
E:GLU238
|
2.4
|
76.3
|
1.0
|
CD
|
E:GLU238
|
2.6
|
75.2
|
1.0
|
CD
|
E:GLU115
|
2.9
|
74.0
|
1.0
|
CE1
|
E:HIS241
|
2.9
|
73.1
|
1.0
|
OE1
|
E:GLU115
|
3.0
|
75.1
|
1.0
|
FE1
|
E:FEO501
|
3.2
|
81.3
|
1.0
|
CD
|
E:GLU204
|
3.2
|
75.3
|
1.0
|
CG
|
E:HIS241
|
3.4
|
73.2
|
1.0
|
O
|
E:HOH601
|
3.5
|
75.9
|
1.0
|
CG
|
E:GLU204
|
3.7
|
77.5
|
1.0
|
CB
|
E:HIS241
|
3.9
|
73.4
|
1.0
|
OD1
|
E:ASP84
|
4.0
|
77.7
|
1.0
|
CG
|
E:GLU238
|
4.1
|
74.9
|
1.0
|
NE2
|
E:HIS241
|
4.2
|
72.7
|
1.0
|
OE2
|
E:GLU204
|
4.2
|
73.4
|
1.0
|
CG
|
E:GLU115
|
4.3
|
71.9
|
1.0
|
NE1
|
E:TRP111
|
4.3
|
72.0
|
1.0
|
CD2
|
E:HIS241
|
4.4
|
73.1
|
1.0
|
CB
|
E:GLU204
|
4.5
|
77.5
|
1.0
|
CA
|
E:GLU238
|
4.5
|
73.7
|
1.0
|
CE1
|
E:HIS118
|
4.6
|
73.1
|
1.0
|
ND1
|
E:HIS118
|
4.7
|
72.9
|
1.0
|
CB
|
E:GLU238
|
4.7
|
74.4
|
1.0
|
NE2
|
E:GLN87
|
4.8
|
75.5
|
1.0
|
CD1
|
E:TRP111
|
4.9
|
72.9
|
1.0
|
|
Iron binding site 3 out
of 8 in 5cnv
Go back to
Iron Binding Sites List in 5cnv
Iron binding site 3 out
of 8 in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms 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 the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Fe501
b:49.9
occ:1.00
|
FE1
|
F:FEO501
|
0.0
|
49.9
|
1.0
|
O
|
F:FEO501
|
1.8
|
47.0
|
1.0
|
O
|
F:HOH601
|
2.0
|
47.1
|
1.0
|
OE1
|
F:GLU115
|
2.0
|
44.2
|
1.0
|
OD1
|
F:ASP84
|
2.1
|
49.2
|
1.0
|
OD2
|
F:ASP84
|
2.1
|
47.6
|
1.0
|
ND1
|
F:HIS118
|
2.2
|
44.0
|
1.0
|
CG
|
F:ASP84
|
2.4
|
48.8
|
1.0
|
CE1
|
F:HIS118
|
3.0
|
43.5
|
1.0
|
CD
|
F:GLU115
|
3.1
|
43.8
|
1.0
|
O
|
F:HOH602
|
3.1
|
46.6
|
1.0
|
FE2
|
F:FEO501
|
3.2
|
47.6
|
1.0
|
OE1
|
F:GLU238
|
3.3
|
48.6
|
1.0
|
CG
|
F:HIS118
|
3.3
|
44.6
|
1.0
|
OE2
|
F:GLU115
|
3.4
|
44.6
|
1.0
|
CB
|
F:HIS118
|
3.8
|
44.9
|
1.0
|
CB
|
F:ASP84
|
3.9
|
47.0
|
1.0
|
NE2
|
F:HIS118
|
4.2
|
43.7
|
1.0
|
CZ
|
F:PHE208
|
4.2
|
51.1
|
1.0
|
CE2
|
F:PHE208
|
4.2
|
51.4
|
1.0
|
CD2
|
F:HIS118
|
4.4
|
43.9
|
1.0
|
CE1
|
F:HIS241
|
4.4
|
44.5
|
1.0
|
CG
|
F:GLU115
|
4.4
|
43.5
|
1.0
|
CG2
|
F:ILE234
|
4.5
|
42.6
|
1.0
|
CD
|
F:GLU238
|
4.5
|
48.5
|
1.0
|
ND1
|
F:HIS241
|
4.6
|
44.8
|
1.0
|
CA
|
F:GLU115
|
4.6
|
43.6
|
1.0
|
CB
|
F:GLU115
|
4.7
|
43.4
|
1.0
|
CA
|
F:ASP84
|
4.7
|
46.2
|
1.0
|
CE1
|
F:PHE208
|
4.9
|
49.4
|
1.0
|
CD2
|
F:PHE208
|
4.9
|
50.8
|
1.0
|
|
Iron binding site 4 out
of 8 in 5cnv
Go back to
Iron Binding Sites List in 5cnv
Iron binding site 4 out
of 8 in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms 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 the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Fe501
b:47.6
occ:1.00
|
FE2
|
F:FEO501
|
0.0
|
47.6
|
1.0
|
O
|
F:FEO501
|
1.8
|
47.0
|
1.0
|
O
|
F:HOH602
|
2.0
|
46.6
|
1.0
|
OE1
|
F:GLU204
|
2.0
|
44.2
|
1.0
|
OE2
|
F:GLU115
|
2.0
|
44.6
|
1.0
|
OE1
|
F:GLU238
|
2.1
|
48.6
|
1.0
|
ND1
|
F:HIS241
|
2.2
|
44.8
|
1.0
|
OE2
|
F:GLU238
|
2.5
|
48.6
|
1.0
|
CD
|
F:GLU238
|
2.6
|
48.5
|
1.0
|
CE1
|
F:HIS241
|
2.9
|
44.5
|
1.0
|
CD
|
F:GLU115
|
3.0
|
43.8
|
1.0
|
CD
|
F:GLU204
|
3.1
|
46.9
|
1.0
|
FE1
|
F:FEO501
|
3.2
|
49.9
|
1.0
|
OE1
|
F:GLU115
|
3.2
|
44.2
|
1.0
|
CG
|
F:HIS241
|
3.4
|
45.6
|
1.0
|
O
|
F:HOH601
|
3.6
|
47.1
|
1.0
|
CG
|
F:GLU204
|
3.7
|
46.4
|
1.0
|
CB
|
F:HIS241
|
3.9
|
45.1
|
1.0
|
OD1
|
F:ASP84
|
3.9
|
49.2
|
1.0
|
CG
|
F:GLU238
|
4.1
|
47.1
|
1.0
|
OE2
|
F:GLU204
|
4.2
|
48.6
|
1.0
|
NE2
|
F:HIS241
|
4.2
|
43.6
|
1.0
|
NE1
|
F:TRP111
|
4.3
|
42.3
|
1.0
|
CG
|
F:GLU115
|
4.3
|
43.5
|
1.0
|
CD2
|
F:HIS241
|
4.4
|
44.8
|
1.0
|
CB
|
F:GLU204
|
4.5
|
46.1
|
1.0
|
NE2
|
F:GLN87
|
4.6
|
44.1
|
1.0
|
CE1
|
F:HIS118
|
4.6
|
43.5
|
1.0
|
CA
|
F:GLU238
|
4.6
|
45.0
|
1.0
|
ND1
|
F:HIS118
|
4.6
|
44.0
|
1.0
|
CB
|
F:GLU238
|
4.8
|
44.5
|
1.0
|
CG
|
F:GLN87
|
4.8
|
44.8
|
1.0
|
CD1
|
F:TRP111
|
4.9
|
43.3
|
1.0
|
CG
|
F:ASP84
|
5.0
|
48.8
|
1.0
|
|
Iron binding site 5 out
of 8 in 5cnv
Go back to
Iron Binding Sites List in 5cnv
Iron binding site 5 out
of 8 in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 5 of Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Fe501
b:47.6
occ:1.00
|
FE1
|
G:FEO501
|
0.0
|
47.6
|
1.0
|
O
|
G:FEO501
|
1.8
|
43.9
|
1.0
|
O
|
G:HOH601
|
2.0
|
44.3
|
1.0
|
OE1
|
G:GLU115
|
2.0
|
44.3
|
1.0
|
OD2
|
G:ASP84
|
2.1
|
47.2
|
1.0
|
OD1
|
G:ASP84
|
2.1
|
47.3
|
1.0
|
ND1
|
G:HIS118
|
2.3
|
44.0
|
1.0
|
CG
|
G:ASP84
|
2.4
|
47.5
|
1.0
|
OE1
|
G:GLU238
|
3.0
|
44.5
|
1.0
|
CE1
|
G:HIS118
|
3.0
|
44.6
|
1.0
|
CD
|
G:GLU115
|
3.1
|
43.7
|
1.0
|
FE2
|
G:FEO501
|
3.2
|
45.6
|
1.0
|
O
|
G:HOH603
|
3.2
|
44.3
|
1.0
|
OE2
|
G:GLU115
|
3.4
|
43.7
|
1.0
|
CG
|
G:HIS118
|
3.4
|
44.2
|
1.0
|
CB
|
G:ASP84
|
3.9
|
46.8
|
1.0
|
CB
|
G:HIS118
|
3.9
|
45.1
|
1.0
|
CD
|
G:GLU238
|
4.2
|
44.3
|
1.0
|
NE2
|
G:HIS118
|
4.2
|
44.3
|
1.0
|
CG
|
G:GLU115
|
4.4
|
42.7
|
1.0
|
CE1
|
G:HIS241
|
4.4
|
42.3
|
1.0
|
CZ
|
G:PHE208
|
4.4
|
47.9
|
1.0
|
CE2
|
G:PHE208
|
4.4
|
47.4
|
1.0
|
CD2
|
G:HIS118
|
4.5
|
44.3
|
1.0
|
ND1
|
G:HIS241
|
4.5
|
42.8
|
1.0
|
CG2
|
G:ILE234
|
4.5
|
44.6
|
1.0
|
CA
|
G:GLU115
|
4.7
|
43.6
|
1.0
|
CB
|
G:GLU115
|
4.7
|
43.2
|
1.0
|
CA
|
G:ASP84
|
4.8
|
46.7
|
1.0
|
OE2
|
G:GLU238
|
4.8
|
44.9
|
1.0
|
|
Iron binding site 6 out
of 8 in 5cnv
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Iron Binding Sites List in 5cnv
Iron binding site 6 out
of 8 in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 6 of Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Fe501
b:45.6
occ:1.00
|
FE2
|
G:FEO501
|
0.0
|
45.6
|
1.0
|
O
|
G:FEO501
|
1.8
|
43.9
|
1.0
|
O
|
G:HOH603
|
2.0
|
44.3
|
1.0
|
OE2
|
G:GLU115
|
2.0
|
43.7
|
1.0
|
OE1
|
G:GLU204
|
2.1
|
41.5
|
1.0
|
OE1
|
G:GLU238
|
2.1
|
44.5
|
1.0
|
ND1
|
G:HIS241
|
2.3
|
42.8
|
1.0
|
OE2
|
G:GLU238
|
2.3
|
44.9
|
1.0
|
CD
|
G:GLU238
|
2.5
|
44.3
|
1.0
|
CD
|
G:GLU115
|
3.0
|
43.7
|
1.0
|
CE1
|
G:HIS241
|
3.1
|
42.3
|
1.0
|
CD
|
G:GLU204
|
3.1
|
42.9
|
1.0
|
FE1
|
G:FEO501
|
3.2
|
47.6
|
1.0
|
OE1
|
G:GLU115
|
3.3
|
44.3
|
1.0
|
CG
|
G:HIS241
|
3.4
|
43.1
|
1.0
|
CG
|
G:GLU204
|
3.7
|
44.3
|
1.0
|
CB
|
G:HIS241
|
3.8
|
42.5
|
1.0
|
O
|
G:HOH601
|
3.8
|
44.3
|
1.0
|
OD1
|
G:ASP84
|
3.9
|
47.3
|
1.0
|
CG
|
G:GLU238
|
4.0
|
43.2
|
1.0
|
NE1
|
G:TRP111
|
4.2
|
41.1
|
1.0
|
OE2
|
G:GLU204
|
4.2
|
43.7
|
1.0
|
NE2
|
G:HIS241
|
4.3
|
41.0
|
1.0
|
CG
|
G:GLU115
|
4.3
|
42.7
|
1.0
|
CD2
|
G:HIS241
|
4.4
|
42.5
|
1.0
|
CA
|
G:GLU238
|
4.5
|
42.4
|
1.0
|
CB
|
G:GLU204
|
4.5
|
42.8
|
1.0
|
NE2
|
G:GLN87
|
4.6
|
42.7
|
1.0
|
CB
|
G:GLU238
|
4.7
|
42.9
|
1.0
|
CE1
|
G:HIS118
|
4.8
|
44.6
|
1.0
|
ND1
|
G:HIS118
|
4.8
|
44.0
|
1.0
|
CD1
|
G:TRP111
|
4.8
|
40.6
|
1.0
|
CG
|
G:GLN87
|
4.8
|
44.7
|
1.0
|
CG
|
G:ASP84
|
4.9
|
47.5
|
1.0
|
|
Iron binding site 7 out
of 8 in 5cnv
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Iron Binding Sites List in 5cnv
Iron binding site 7 out
of 8 in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 7 of Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Fe501
b:63.3
occ:1.00
|
FE1
|
H:FEO501
|
0.0
|
63.3
|
1.0
|
O
|
H:FEO501
|
1.8
|
63.0
|
1.0
|
O
|
H:HOH603
|
2.0
|
62.3
|
1.0
|
OE1
|
H:GLU115
|
2.1
|
64.7
|
1.0
|
OD1
|
H:ASP84
|
2.1
|
64.8
|
1.0
|
OD2
|
H:ASP84
|
2.1
|
63.5
|
1.0
|
ND1
|
H:HIS118
|
2.3
|
62.6
|
1.0
|
CG
|
H:ASP84
|
2.4
|
64.1
|
1.0
|
O
|
H:HOH606
|
3.0
|
63.7
|
1.0
|
CE1
|
H:HIS118
|
3.1
|
63.2
|
1.0
|
FE2
|
H:FEO501
|
3.2
|
62.8
|
1.0
|
CD
|
H:GLU115
|
3.2
|
64.2
|
1.0
|
OE1
|
H:GLU238
|
3.3
|
64.1
|
1.0
|
CG
|
H:HIS118
|
3.4
|
63.0
|
1.0
|
OE2
|
H:GLU115
|
3.6
|
64.6
|
1.0
|
CB
|
H:HIS118
|
3.8
|
62.9
|
1.0
|
CB
|
H:ASP84
|
3.9
|
63.1
|
1.0
|
CZ
|
H:PHE208
|
4.2
|
63.9
|
1.0
|
CE2
|
H:PHE208
|
4.3
|
62.8
|
1.0
|
NE2
|
H:HIS118
|
4.3
|
62.8
|
1.0
|
CG
|
H:GLU115
|
4.4
|
63.0
|
1.0
|
CG2
|
H:ILE234
|
4.5
|
59.6
|
1.0
|
CD2
|
H:HIS118
|
4.5
|
63.1
|
1.0
|
CD
|
H:GLU238
|
4.5
|
62.9
|
1.0
|
CA
|
H:GLU115
|
4.6
|
64.8
|
1.0
|
CE1
|
H:HIS241
|
4.6
|
62.2
|
1.0
|
CB
|
H:GLU115
|
4.6
|
65.0
|
1.0
|
CA
|
H:ASP84
|
4.7
|
64.5
|
1.0
|
ND1
|
H:HIS241
|
4.8
|
62.8
|
1.0
|
CE1
|
H:PHE208
|
4.8
|
63.4
|
1.0
|
CD2
|
H:PHE208
|
5.0
|
63.0
|
1.0
|
O
|
H:GLU115
|
5.0
|
64.0
|
1.0
|
|
Iron binding site 8 out
of 8 in 5cnv
Go back to
Iron Binding Sites List in 5cnv
Iron binding site 8 out
of 8 in the Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 8 of Crystal Structure of the Datp Inhibited E. Coli Class Ia Ribonucleotide Reductase Complex Bound to Gdp and Ttp at 3.20 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Fe501
b:62.8
occ:1.00
|
FE2
|
H:FEO501
|
0.0
|
62.8
|
1.0
|
O
|
H:FEO501
|
1.8
|
63.0
|
1.0
|
O
|
H:HOH606
|
2.0
|
63.7
|
1.0
|
OE2
|
H:GLU115
|
2.0
|
64.6
|
1.0
|
OE1
|
H:GLU204
|
2.1
|
61.4
|
1.0
|
OE1
|
H:GLU238
|
2.1
|
64.1
|
1.0
|
ND1
|
H:HIS241
|
2.3
|
62.8
|
1.0
|
OE2
|
H:GLU238
|
2.6
|
64.2
|
1.0
|
CD
|
H:GLU238
|
2.7
|
62.9
|
1.0
|
CD
|
H:GLU115
|
2.9
|
64.2
|
1.0
|
CE1
|
H:HIS241
|
2.9
|
62.2
|
1.0
|
OE1
|
H:GLU115
|
3.0
|
64.7
|
1.0
|
FE1
|
H:FEO501
|
3.2
|
63.3
|
1.0
|
CD
|
H:GLU204
|
3.2
|
63.0
|
1.0
|
CG
|
H:HIS241
|
3.5
|
64.2
|
1.0
|
O
|
H:HOH603
|
3.6
|
62.3
|
1.0
|
CG
|
H:GLU204
|
3.7
|
63.7
|
1.0
|
CB
|
H:HIS241
|
4.0
|
63.3
|
1.0
|
OD1
|
H:ASP84
|
4.0
|
64.8
|
1.0
|
CG
|
H:GLU238
|
4.1
|
60.8
|
1.0
|
NE2
|
H:HIS241
|
4.2
|
61.9
|
1.0
|
OE2
|
H:GLU204
|
4.2
|
63.1
|
1.0
|
CG
|
H:GLU115
|
4.3
|
63.0
|
1.0
|
NE1
|
H:TRP111
|
4.3
|
63.1
|
1.0
|
CD2
|
H:HIS241
|
4.4
|
63.6
|
1.0
|
CE1
|
H:HIS118
|
4.5
|
63.2
|
1.0
|
ND1
|
H:HIS118
|
4.6
|
62.6
|
1.0
|
CB
|
H:GLU204
|
4.6
|
64.4
|
1.0
|
CA
|
H:GLU238
|
4.6
|
61.3
|
1.0
|
NE2
|
H:GLN87
|
4.7
|
66.0
|
1.0
|
CB
|
H:GLU238
|
4.8
|
61.2
|
1.0
|
CD1
|
H:TRP111
|
4.9
|
62.8
|
1.0
|
CG
|
H:GLN87
|
5.0
|
65.4
|
1.0
|
CG
|
H:ASP84
|
5.0
|
64.1
|
1.0
|
|
Reference:
C.M.Zimanyi,
P.Y.Chen,
G.Kang,
M.A.Funk,
C.L.Drennan.
Molecular Basis For Allosteric Specificity Regulation in Class Ia Ribonucleotide Reductase From Escherichia Coli. Elife V. 5 07141 2016.
ISSN: ESSN 2050-084X
PubMed: 26754917
DOI: 10.7554/ELIFE.07141
Page generated: Mon Aug 5 21:34:12 2024
|