Iron in PDB 1gcv: Deoxy Form Hemoglobin From Mustelus Griseus
Protein crystallography data
The structure of Deoxy Form Hemoglobin From Mustelus Griseus, PDB code: 1gcv
was solved by
Y.Naoi,
K.T.Chong,
K.Yoshimatsu,
G.Miyazaki,
J.R.H.Tame,
S.Y.Park,
S.I.Adachi,
H.Morimoto,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
10.00 /
2.00
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
57.680,
90.550,
61.450,
90.00,
98.45,
90.00
|
R / Rfree (%)
|
18.1 /
22.3
|
Iron Binding Sites:
The binding sites of Iron atom in the Deoxy Form Hemoglobin From Mustelus Griseus
(pdb code 1gcv). This binding sites where shown within
5.0 Angstroms radius around Iron atom.
In total 4 binding sites of Iron where determined in the
Deoxy Form Hemoglobin From Mustelus Griseus, PDB code: 1gcv:
Jump to Iron binding site number:
1;
2;
3;
4;
Iron binding site 1 out
of 4 in 1gcv
Go back to
Iron Binding Sites List in 1gcv
Iron binding site 1 out
of 4 in the Deoxy Form Hemoglobin From Mustelus Griseus
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 1 of Deoxy Form Hemoglobin From Mustelus Griseus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe141
b:20.3
occ:1.00
|
FE
|
A:HEM141
|
0.0
|
20.3
|
1.0
|
NB
|
A:HEM141
|
2.0
|
18.0
|
1.0
|
ND
|
A:HEM141
|
2.0
|
20.4
|
1.0
|
NA
|
A:HEM141
|
2.0
|
19.7
|
1.0
|
NC
|
A:HEM141
|
2.0
|
17.8
|
1.0
|
NE2
|
A:HIS87
|
2.2
|
16.2
|
1.0
|
CE1
|
A:HIS87
|
3.0
|
14.9
|
1.0
|
C4B
|
A:HEM141
|
3.1
|
17.8
|
1.0
|
C4D
|
A:HEM141
|
3.1
|
21.2
|
1.0
|
C1A
|
A:HEM141
|
3.1
|
19.9
|
1.0
|
C1B
|
A:HEM141
|
3.1
|
18.5
|
1.0
|
C1D
|
A:HEM141
|
3.1
|
19.4
|
1.0
|
C1C
|
A:HEM141
|
3.1
|
13.8
|
1.0
|
C4C
|
A:HEM141
|
3.1
|
15.8
|
1.0
|
C4A
|
A:HEM141
|
3.1
|
19.1
|
1.0
|
CD2
|
A:HIS87
|
3.3
|
13.9
|
1.0
|
CHA
|
A:HEM141
|
3.5
|
20.9
|
1.0
|
CHC
|
A:HEM141
|
3.5
|
14.2
|
1.0
|
CHD
|
A:HEM141
|
3.5
|
17.8
|
1.0
|
CHB
|
A:HEM141
|
3.5
|
17.9
|
1.0
|
NE2
|
A:HIS58
|
4.2
|
30.2
|
1.0
|
ND1
|
A:HIS87
|
4.2
|
16.0
|
1.0
|
C3D
|
A:HEM141
|
4.3
|
22.6
|
1.0
|
C2A
|
A:HEM141
|
4.3
|
20.9
|
1.0
|
CG
|
A:HIS87
|
4.3
|
13.9
|
1.0
|
C2B
|
A:HEM141
|
4.3
|
19.3
|
1.0
|
C3B
|
A:HEM141
|
4.3
|
20.9
|
1.0
|
C2D
|
A:HEM141
|
4.3
|
19.4
|
1.0
|
C3C
|
A:HEM141
|
4.3
|
16.8
|
1.0
|
C3A
|
A:HEM141
|
4.3
|
20.1
|
1.0
|
C2C
|
A:HEM141
|
4.3
|
16.0
|
1.0
|
CE1
|
A:HIS58
|
4.6
|
28.0
|
1.0
|
CG2
|
A:VAL62
|
4.8
|
16.7
|
1.0
|
CD1
|
A:LEU91
|
4.8
|
15.1
|
1.0
|
|
Iron binding site 2 out
of 4 in 1gcv
Go back to
Iron Binding Sites List in 1gcv
Iron binding site 2 out
of 4 in the Deoxy Form Hemoglobin From Mustelus Griseus
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 2 of Deoxy Form Hemoglobin From Mustelus Griseus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Fe137
b:21.8
occ:1.00
|
FE
|
B:HEM137
|
0.0
|
21.8
|
1.0
|
NA
|
B:HEM137
|
2.0
|
24.6
|
1.0
|
ND
|
B:HEM137
|
2.0
|
25.6
|
1.0
|
NB
|
B:HEM137
|
2.0
|
21.3
|
1.0
|
NC
|
B:HEM137
|
2.0
|
22.7
|
1.0
|
NE2
|
B:HIS82
|
2.2
|
18.4
|
1.0
|
C4D
|
B:HEM137
|
3.1
|
28.4
|
1.0
|
C1A
|
B:HEM137
|
3.1
|
24.8
|
1.0
|
C1D
|
B:HEM137
|
3.1
|
23.9
|
1.0
|
C4B
|
B:HEM137
|
3.1
|
20.2
|
1.0
|
C4A
|
B:HEM137
|
3.1
|
23.5
|
1.0
|
C1C
|
B:HEM137
|
3.1
|
23.1
|
1.0
|
C4C
|
B:HEM137
|
3.1
|
21.6
|
1.0
|
C1B
|
B:HEM137
|
3.1
|
21.2
|
1.0
|
CE1
|
B:HIS82
|
3.1
|
17.1
|
1.0
|
CD2
|
B:HIS82
|
3.3
|
17.0
|
1.0
|
CHC
|
B:HEM137
|
3.4
|
19.2
|
1.0
|
CHA
|
B:HEM137
|
3.4
|
27.5
|
1.0
|
CHD
|
B:HEM137
|
3.5
|
22.4
|
1.0
|
CHB
|
B:HEM137
|
3.5
|
19.8
|
1.0
|
C2A
|
B:HEM137
|
4.3
|
27.7
|
1.0
|
NE2
|
B:HIS53
|
4.3
|
30.6
|
1.0
|
C3A
|
B:HEM137
|
4.3
|
26.7
|
1.0
|
C3D
|
B:HEM137
|
4.3
|
30.1
|
1.0
|
C2D
|
B:HEM137
|
4.3
|
26.9
|
1.0
|
C2B
|
B:HEM137
|
4.3
|
23.1
|
1.0
|
C3B
|
B:HEM137
|
4.3
|
23.1
|
1.0
|
C3C
|
B:HEM137
|
4.3
|
22.9
|
1.0
|
C2C
|
B:HEM137
|
4.3
|
19.4
|
1.0
|
ND1
|
B:HIS82
|
4.4
|
19.1
|
1.0
|
CG
|
B:HIS82
|
4.4
|
18.0
|
1.0
|
CE1
|
B:HIS53
|
4.5
|
29.2
|
1.0
|
CG2
|
B:VAL57
|
5.0
|
20.7
|
1.0
|
|
Iron binding site 3 out
of 4 in 1gcv
Go back to
Iron Binding Sites List in 1gcv
Iron binding site 3 out
of 4 in the Deoxy Form Hemoglobin From Mustelus Griseus
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 3 of Deoxy Form Hemoglobin From Mustelus Griseus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Fe141
b:19.3
occ:1.00
|
FE
|
C:HEM141
|
0.0
|
19.3
|
1.0
|
NA
|
C:HEM141
|
2.0
|
21.9
|
1.0
|
ND
|
C:HEM141
|
2.0
|
20.6
|
1.0
|
NB
|
C:HEM141
|
2.0
|
19.5
|
1.0
|
NC
|
C:HEM141
|
2.1
|
19.9
|
1.0
|
NE2
|
C:HIS87
|
2.3
|
20.5
|
1.0
|
C1A
|
C:HEM141
|
3.1
|
21.9
|
1.0
|
C4D
|
C:HEM141
|
3.1
|
20.5
|
1.0
|
C4B
|
C:HEM141
|
3.1
|
17.9
|
1.0
|
C1B
|
C:HEM141
|
3.1
|
19.4
|
1.0
|
C4A
|
C:HEM141
|
3.1
|
21.9
|
1.0
|
C1C
|
C:HEM141
|
3.1
|
19.8
|
1.0
|
C1D
|
C:HEM141
|
3.1
|
22.4
|
1.0
|
C4C
|
C:HEM141
|
3.2
|
17.8
|
1.0
|
CE1
|
C:HIS87
|
3.2
|
19.4
|
1.0
|
CD2
|
C:HIS87
|
3.3
|
17.1
|
1.0
|
CHA
|
C:HEM141
|
3.5
|
19.4
|
1.0
|
CHC
|
C:HEM141
|
3.5
|
18.8
|
1.0
|
CHB
|
C:HEM141
|
3.5
|
19.9
|
1.0
|
CHD
|
C:HEM141
|
3.6
|
19.0
|
1.0
|
NE2
|
C:HIS58
|
4.2
|
24.1
|
1.0
|
C2B
|
C:HEM141
|
4.3
|
20.1
|
1.0
|
C2A
|
C:HEM141
|
4.3
|
24.4
|
1.0
|
C3A
|
C:HEM141
|
4.3
|
23.2
|
1.0
|
C3D
|
C:HEM141
|
4.3
|
23.4
|
1.0
|
C3B
|
C:HEM141
|
4.3
|
17.6
|
1.0
|
C2D
|
C:HEM141
|
4.4
|
21.2
|
1.0
|
C2C
|
C:HEM141
|
4.4
|
19.1
|
1.0
|
CE1
|
C:HIS58
|
4.4
|
21.7
|
1.0
|
ND1
|
C:HIS87
|
4.4
|
19.6
|
1.0
|
C3C
|
C:HEM141
|
4.4
|
19.4
|
1.0
|
CG
|
C:HIS87
|
4.5
|
18.6
|
1.0
|
CG2
|
C:VAL62
|
4.7
|
17.1
|
1.0
|
CD1
|
C:LEU91
|
5.0
|
16.8
|
1.0
|
|
Iron binding site 4 out
of 4 in 1gcv
Go back to
Iron Binding Sites List in 1gcv
Iron binding site 4 out
of 4 in the Deoxy Form Hemoglobin From Mustelus Griseus
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 4 of Deoxy Form Hemoglobin From Mustelus Griseus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Fe137
b:20.7
occ:1.00
|
FE
|
D:HEM137
|
0.0
|
20.7
|
1.0
|
NC
|
D:HEM137
|
2.0
|
17.8
|
1.0
|
ND
|
D:HEM137
|
2.0
|
19.7
|
1.0
|
NA
|
D:HEM137
|
2.0
|
21.3
|
1.0
|
NB
|
D:HEM137
|
2.0
|
20.5
|
1.0
|
NE2
|
D:HIS82
|
2.2
|
18.8
|
1.0
|
C4C
|
D:HEM137
|
3.0
|
17.7
|
1.0
|
C1D
|
D:HEM137
|
3.0
|
18.7
|
1.0
|
C1C
|
D:HEM137
|
3.0
|
16.6
|
1.0
|
C1A
|
D:HEM137
|
3.1
|
22.4
|
1.0
|
C4D
|
D:HEM137
|
3.1
|
20.7
|
1.0
|
C4B
|
D:HEM137
|
3.1
|
20.0
|
1.0
|
C4A
|
D:HEM137
|
3.1
|
21.7
|
1.0
|
C1B
|
D:HEM137
|
3.1
|
21.5
|
1.0
|
CE1
|
D:HIS82
|
3.1
|
15.2
|
1.0
|
CD2
|
D:HIS82
|
3.2
|
15.8
|
1.0
|
CHD
|
D:HEM137
|
3.4
|
19.8
|
1.0
|
CHC
|
D:HEM137
|
3.5
|
18.3
|
1.0
|
CHA
|
D:HEM137
|
3.5
|
21.9
|
1.0
|
CHB
|
D:HEM137
|
3.5
|
20.1
|
1.0
|
C2D
|
D:HEM137
|
4.3
|
20.2
|
1.0
|
C2C
|
D:HEM137
|
4.3
|
19.1
|
1.0
|
C3C
|
D:HEM137
|
4.3
|
20.9
|
1.0
|
C2A
|
D:HEM137
|
4.3
|
22.9
|
1.0
|
ND1
|
D:HIS82
|
4.3
|
17.0
|
1.0
|
C3D
|
D:HEM137
|
4.3
|
22.2
|
1.0
|
CG
|
D:HIS82
|
4.3
|
15.4
|
1.0
|
C3A
|
D:HEM137
|
4.3
|
24.7
|
1.0
|
C3B
|
D:HEM137
|
4.3
|
22.7
|
1.0
|
C2B
|
D:HEM137
|
4.3
|
19.9
|
1.0
|
NE2
|
D:HIS53
|
4.5
|
36.6
|
1.0
|
CE1
|
D:HIS53
|
4.6
|
35.5
|
1.0
|
CG2
|
D:VAL57
|
5.0
|
18.2
|
1.0
|
|
Reference:
Y.Naoi,
K.T.Chong,
K.Yoshimatsu,
G.Miyazaki,
J.R.Tame,
S.Y.Park,
S.Adachi,
H.Morimoto.
The Functional Similarity and Structural Diversity of Human and Cartilaginous Fish Hemoglobins. J.Mol.Biol. V. 307 259 2001.
ISSN: ISSN 0022-2836
PubMed: 11243818
DOI: 10.1006/JMBI.2000.4446
Page generated: Sat Aug 3 05:52:20 2024
|