Iron in PDB 1uiw: Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Protein crystallography data
The structure of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2, PDB code: 1uiw
was solved by
S.-Y.Park,
N.Shibayama,
J.R.H.Tame,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.11 /
1.50
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
66.137,
96.338,
102.476,
90.00,
101.79,
90.00
|
R / Rfree (%)
|
17.2 /
20.5
|
Iron Binding Sites:
The binding sites of Iron atom in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
(pdb code 1uiw). 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 Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2, PDB code: 1uiw:
Jump to Iron binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Iron binding site 1 out
of 8 in 1uiw
Go back to
Iron Binding Sites List in 1uiw
Iron binding site 1 out
of 8 in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 1 of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Fe142
b:7.0
occ:1.00
|
FE
|
A:HEM142
|
0.0
|
7.0
|
1.0
|
NB
|
A:HEM142
|
2.1
|
8.0
|
1.0
|
NC
|
A:HEM142
|
2.1
|
5.9
|
1.0
|
NA
|
A:HEM142
|
2.1
|
7.7
|
1.0
|
ND
|
A:HEM142
|
2.2
|
7.3
|
1.0
|
NE2
|
A:HIS87
|
2.3
|
6.6
|
1.0
|
C4B
|
A:HEM142
|
3.1
|
6.6
|
1.0
|
CE1
|
A:HIS87
|
3.1
|
8.4
|
1.0
|
C1C
|
A:HEM142
|
3.1
|
6.8
|
1.0
|
C1B
|
A:HEM142
|
3.2
|
6.8
|
1.0
|
C4A
|
A:HEM142
|
3.2
|
7.0
|
1.0
|
C1A
|
A:HEM142
|
3.2
|
7.5
|
1.0
|
C4C
|
A:HEM142
|
3.2
|
5.7
|
1.0
|
C1D
|
A:HEM142
|
3.2
|
6.0
|
1.0
|
C4D
|
A:HEM142
|
3.2
|
7.0
|
1.0
|
CD2
|
A:HIS87
|
3.4
|
7.7
|
1.0
|
CHC
|
A:HEM142
|
3.5
|
7.8
|
1.0
|
CHA
|
A:HEM142
|
3.5
|
7.6
|
1.0
|
CHB
|
A:HEM142
|
3.5
|
7.4
|
1.0
|
CHD
|
A:HEM142
|
3.5
|
6.2
|
1.0
|
O
|
A:HOH153
|
3.6
|
11.8
|
1.0
|
ND1
|
A:HIS87
|
4.3
|
8.1
|
1.0
|
C3B
|
A:HEM142
|
4.4
|
7.5
|
1.0
|
C2B
|
A:HEM142
|
4.4
|
6.8
|
1.0
|
C3A
|
A:HEM142
|
4.4
|
8.5
|
1.0
|
C2C
|
A:HEM142
|
4.4
|
6.6
|
1.0
|
C3C
|
A:HEM142
|
4.4
|
6.2
|
1.0
|
C2A
|
A:HEM142
|
4.4
|
9.1
|
1.0
|
C2D
|
A:HEM142
|
4.4
|
6.9
|
1.0
|
C3D
|
A:HEM142
|
4.4
|
7.6
|
1.0
|
CG
|
A:HIS87
|
4.5
|
6.8
|
1.0
|
CE1
|
A:HIS58
|
4.5
|
8.9
|
1.0
|
CD1
|
A:LEU91
|
4.6
|
9.4
|
1.0
|
NE2
|
A:HIS58
|
4.6
|
10.6
|
1.0
|
|
Iron binding site 2 out
of 8 in 1uiw
Go back to
Iron Binding Sites List in 1uiw
Iron binding site 2 out
of 8 in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 2 of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Fe147
b:9.9
occ:1.00
|
FE
|
B:HEM147
|
0.0
|
9.9
|
1.0
|
ND
|
B:HEM147
|
2.1
|
10.1
|
1.0
|
NC
|
B:HEM147
|
2.1
|
8.7
|
1.0
|
NA
|
B:HEM147
|
2.1
|
11.0
|
1.0
|
NB
|
B:HEM147
|
2.1
|
10.1
|
1.0
|
NE2
|
B:HIS92
|
2.2
|
9.9
|
1.0
|
C4D
|
B:HEM147
|
3.1
|
10.4
|
1.0
|
C4C
|
B:HEM147
|
3.1
|
9.4
|
1.0
|
C1D
|
B:HEM147
|
3.1
|
10.5
|
1.0
|
C1B
|
B:HEM147
|
3.1
|
9.3
|
1.0
|
C4A
|
B:HEM147
|
3.1
|
10.8
|
1.0
|
C4B
|
B:HEM147
|
3.1
|
9.1
|
1.0
|
CE1
|
B:HIS92
|
3.1
|
12.4
|
1.0
|
C1A
|
B:HEM147
|
3.1
|
11.5
|
1.0
|
C1C
|
B:HEM147
|
3.1
|
9.2
|
1.0
|
CD2
|
B:HIS92
|
3.3
|
9.1
|
1.0
|
CHD
|
B:HEM147
|
3.5
|
11.2
|
1.0
|
CHB
|
B:HEM147
|
3.5
|
10.8
|
1.0
|
CHA
|
B:HEM147
|
3.5
|
12.7
|
1.0
|
CHC
|
B:HEM147
|
3.5
|
8.9
|
1.0
|
CG2
|
B:VAL67
|
4.2
|
9.5
|
1.0
|
NE2
|
B:HIS63
|
4.2
|
12.9
|
1.0
|
ND1
|
B:HIS92
|
4.3
|
11.7
|
1.0
|
C2B
|
B:HEM147
|
4.3
|
9.3
|
1.0
|
C3C
|
B:HEM147
|
4.4
|
9.4
|
1.0
|
C3D
|
B:HEM147
|
4.4
|
11.9
|
1.0
|
C2D
|
B:HEM147
|
4.4
|
12.4
|
1.0
|
C3B
|
B:HEM147
|
4.4
|
9.9
|
1.0
|
C2C
|
B:HEM147
|
4.4
|
9.6
|
1.0
|
C3A
|
B:HEM147
|
4.4
|
12.8
|
1.0
|
C2A
|
B:HEM147
|
4.4
|
12.5
|
1.0
|
CG
|
B:HIS92
|
4.4
|
10.9
|
1.0
|
CE1
|
B:HIS63
|
4.6
|
13.6
|
1.0
|
|
Iron binding site 3 out
of 8 in 1uiw
Go back to
Iron Binding Sites List in 1uiw
Iron binding site 3 out
of 8 in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 3 of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Fe142
b:8.2
occ:1.00
|
FE
|
C:HEM142
|
0.0
|
8.2
|
1.0
|
NB
|
C:HEM142
|
2.1
|
8.1
|
1.0
|
NA
|
C:HEM142
|
2.1
|
7.7
|
1.0
|
NC
|
C:HEM142
|
2.1
|
6.9
|
1.0
|
ND
|
C:HEM142
|
2.2
|
9.1
|
1.0
|
NE2
|
C:HIS87
|
2.3
|
8.4
|
1.0
|
C4A
|
C:HEM142
|
3.1
|
7.7
|
1.0
|
C1B
|
C:HEM142
|
3.1
|
8.1
|
1.0
|
CE1
|
C:HIS87
|
3.1
|
8.2
|
1.0
|
C1D
|
C:HEM142
|
3.1
|
7.0
|
1.0
|
C4C
|
C:HEM142
|
3.1
|
7.4
|
1.0
|
C4B
|
C:HEM142
|
3.2
|
8.2
|
1.0
|
C1C
|
C:HEM142
|
3.2
|
7.9
|
1.0
|
C1A
|
C:HEM142
|
3.2
|
9.1
|
1.0
|
C4D
|
C:HEM142
|
3.2
|
6.8
|
1.0
|
CD2
|
C:HIS87
|
3.4
|
7.8
|
1.0
|
O
|
C:HOH163
|
3.4
|
18.8
|
1.0
|
CHB
|
C:HEM142
|
3.5
|
8.2
|
1.0
|
CHD
|
C:HEM142
|
3.5
|
7.8
|
1.0
|
CHC
|
C:HEM142
|
3.5
|
7.7
|
1.0
|
CHA
|
C:HEM142
|
3.5
|
7.5
|
1.0
|
ND1
|
C:HIS87
|
4.3
|
7.7
|
1.0
|
C3B
|
C:HEM142
|
4.4
|
8.9
|
1.0
|
C3A
|
C:HEM142
|
4.4
|
9.8
|
1.0
|
C2B
|
C:HEM142
|
4.4
|
7.9
|
1.0
|
C2C
|
C:HEM142
|
4.4
|
6.5
|
1.0
|
C2A
|
C:HEM142
|
4.4
|
9.5
|
1.0
|
C2D
|
C:HEM142
|
4.4
|
8.8
|
1.0
|
C3C
|
C:HEM142
|
4.4
|
7.6
|
1.0
|
C3D
|
C:HEM142
|
4.4
|
8.1
|
1.0
|
CG
|
C:HIS87
|
4.5
|
7.5
|
1.0
|
CE1
|
C:HIS58
|
4.6
|
14.4
|
1.0
|
CD1
|
C:LEU91
|
4.6
|
10.0
|
1.0
|
NE2
|
C:HIS58
|
4.6
|
14.0
|
1.0
|
|
Iron binding site 4 out
of 8 in 1uiw
Go back to
Iron Binding Sites List in 1uiw
Iron binding site 4 out
of 8 in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 4 of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Fe147
b:8.1
occ:1.00
|
FE
|
D:HEM147
|
0.0
|
8.1
|
1.0
|
NC
|
D:HEM147
|
2.1
|
7.8
|
1.0
|
NA
|
D:HEM147
|
2.1
|
8.4
|
1.0
|
NB
|
D:HEM147
|
2.1
|
7.9
|
1.0
|
ND
|
D:HEM147
|
2.1
|
8.2
|
1.0
|
NE2
|
D:HIS92
|
2.3
|
7.8
|
1.0
|
C4C
|
D:HEM147
|
3.1
|
6.8
|
1.0
|
C4B
|
D:HEM147
|
3.1
|
7.3
|
1.0
|
C4A
|
D:HEM147
|
3.1
|
7.5
|
1.0
|
C1D
|
D:HEM147
|
3.1
|
7.3
|
1.0
|
C1C
|
D:HEM147
|
3.1
|
7.8
|
1.0
|
C1A
|
D:HEM147
|
3.1
|
9.1
|
1.0
|
C1B
|
D:HEM147
|
3.1
|
8.5
|
1.0
|
C4D
|
D:HEM147
|
3.1
|
7.6
|
1.0
|
CE1
|
D:HIS92
|
3.2
|
8.2
|
1.0
|
CD2
|
D:HIS92
|
3.3
|
7.6
|
1.0
|
CHD
|
D:HEM147
|
3.5
|
6.7
|
1.0
|
CHC
|
D:HEM147
|
3.5
|
7.6
|
1.0
|
CHA
|
D:HEM147
|
3.5
|
8.2
|
1.0
|
CHB
|
D:HEM147
|
3.5
|
8.8
|
1.0
|
CG2
|
D:VAL67
|
4.0
|
10.2
|
1.0
|
ND1
|
D:HIS92
|
4.3
|
7.7
|
1.0
|
C3A
|
D:HEM147
|
4.4
|
8.9
|
1.0
|
C2B
|
D:HEM147
|
4.4
|
8.3
|
1.0
|
C3B
|
D:HEM147
|
4.4
|
8.6
|
1.0
|
NE2
|
D:HIS63
|
4.4
|
10.3
|
1.0
|
C3C
|
D:HEM147
|
4.4
|
7.4
|
1.0
|
C2C
|
D:HEM147
|
4.4
|
6.9
|
1.0
|
C2A
|
D:HEM147
|
4.4
|
10.2
|
1.0
|
C2D
|
D:HEM147
|
4.4
|
9.7
|
1.0
|
C3D
|
D:HEM147
|
4.4
|
8.7
|
1.0
|
CG
|
D:HIS92
|
4.4
|
7.3
|
1.0
|
CE1
|
D:HIS63
|
4.9
|
10.8
|
1.0
|
|
Iron binding site 5 out
of 8 in 1uiw
Go back to
Iron Binding Sites List in 1uiw
Iron binding site 5 out
of 8 in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 5 of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Fe142
b:7.1
occ:1.00
|
FE
|
E:HEM142
|
0.0
|
7.1
|
1.0
|
NA
|
E:HEM142
|
2.1
|
6.9
|
1.0
|
NC
|
E:HEM142
|
2.1
|
6.4
|
1.0
|
NB
|
E:HEM142
|
2.1
|
7.8
|
1.0
|
ND
|
E:HEM142
|
2.2
|
8.0
|
1.0
|
NE2
|
E:HIS87
|
2.3
|
8.1
|
1.0
|
C4B
|
E:HEM142
|
3.1
|
6.4
|
1.0
|
CE1
|
E:HIS87
|
3.1
|
9.3
|
1.0
|
C1C
|
E:HEM142
|
3.1
|
5.9
|
1.0
|
C1A
|
E:HEM142
|
3.2
|
8.1
|
1.0
|
C4A
|
E:HEM142
|
3.2
|
8.1
|
1.0
|
C4C
|
E:HEM142
|
3.2
|
6.5
|
1.0
|
C1D
|
E:HEM142
|
3.2
|
6.6
|
1.0
|
C4D
|
E:HEM142
|
3.2
|
7.9
|
1.0
|
C1B
|
E:HEM142
|
3.2
|
8.7
|
1.0
|
CD2
|
E:HIS87
|
3.4
|
8.8
|
1.0
|
CHC
|
E:HEM142
|
3.4
|
6.4
|
1.0
|
O
|
E:HOH147
|
3.5
|
9.4
|
1.0
|
CHA
|
E:HEM142
|
3.5
|
9.0
|
1.0
|
CHD
|
E:HEM142
|
3.5
|
6.4
|
1.0
|
CHB
|
E:HEM142
|
3.5
|
7.1
|
1.0
|
ND1
|
E:HIS87
|
4.3
|
7.2
|
1.0
|
C3A
|
E:HEM142
|
4.4
|
7.7
|
1.0
|
C3B
|
E:HEM142
|
4.4
|
8.1
|
1.0
|
C2C
|
E:HEM142
|
4.4
|
7.0
|
1.0
|
C2A
|
E:HEM142
|
4.4
|
10.2
|
1.0
|
C3C
|
E:HEM142
|
4.4
|
7.4
|
1.0
|
C2B
|
E:HEM142
|
4.4
|
7.5
|
1.0
|
C2D
|
E:HEM142
|
4.4
|
7.0
|
1.0
|
C3D
|
E:HEM142
|
4.4
|
8.1
|
1.0
|
CG
|
E:HIS87
|
4.5
|
7.1
|
1.0
|
CD1
|
E:LEU91
|
4.6
|
9.3
|
1.0
|
CE1
|
E:HIS58
|
4.6
|
8.8
|
1.0
|
NE2
|
E:HIS58
|
4.7
|
9.5
|
1.0
|
|
Iron binding site 6 out
of 8 in 1uiw
Go back to
Iron Binding Sites List in 1uiw
Iron binding site 6 out
of 8 in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 6 of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Fe147
b:12.1
occ:1.00
|
FE
|
F:HEM147
|
0.0
|
12.1
|
1.0
|
NB
|
F:HEM147
|
2.1
|
12.0
|
1.0
|
ND
|
F:HEM147
|
2.1
|
12.7
|
1.0
|
NA
|
F:HEM147
|
2.1
|
13.0
|
1.0
|
NC
|
F:HEM147
|
2.1
|
12.9
|
1.0
|
NE2
|
F:HIS92
|
2.2
|
13.1
|
1.0
|
CE1
|
F:HIS92
|
3.1
|
10.8
|
1.0
|
C1B
|
F:HEM147
|
3.1
|
13.6
|
1.0
|
C1D
|
F:HEM147
|
3.1
|
14.4
|
1.0
|
C4D
|
F:HEM147
|
3.1
|
14.5
|
1.0
|
C4A
|
F:HEM147
|
3.1
|
15.1
|
1.0
|
C4B
|
F:HEM147
|
3.1
|
12.0
|
1.0
|
C4C
|
F:HEM147
|
3.2
|
13.2
|
1.0
|
C1A
|
F:HEM147
|
3.2
|
14.6
|
1.0
|
C1C
|
F:HEM147
|
3.2
|
13.2
|
1.0
|
CD2
|
F:HIS92
|
3.3
|
11.2
|
1.0
|
CHB
|
F:HEM147
|
3.5
|
14.2
|
1.0
|
CHD
|
F:HEM147
|
3.5
|
14.2
|
1.0
|
CHA
|
F:HEM147
|
3.5
|
14.2
|
1.0
|
CHC
|
F:HEM147
|
3.5
|
11.2
|
1.0
|
CG2
|
F:VAL67
|
4.2
|
15.1
|
1.0
|
ND1
|
F:HIS92
|
4.3
|
12.0
|
1.0
|
NE2
|
F:HIS63
|
4.3
|
18.5
|
1.0
|
C2B
|
F:HEM147
|
4.3
|
13.0
|
1.0
|
C3B
|
F:HEM147
|
4.3
|
12.9
|
1.0
|
C3D
|
F:HEM147
|
4.4
|
15.8
|
1.0
|
C2D
|
F:HEM147
|
4.4
|
16.4
|
1.0
|
C3A
|
F:HEM147
|
4.4
|
16.4
|
1.0
|
C2A
|
F:HEM147
|
4.4
|
16.2
|
1.0
|
C2C
|
F:HEM147
|
4.4
|
13.5
|
1.0
|
C3C
|
F:HEM147
|
4.4
|
12.9
|
1.0
|
CG
|
F:HIS92
|
4.4
|
11.1
|
1.0
|
CE1
|
F:HIS63
|
4.7
|
19.2
|
1.0
|
CD1
|
F:LEU96
|
5.0
|
14.4
|
1.0
|
|
Iron binding site 7 out
of 8 in 1uiw
Go back to
Iron Binding Sites List in 1uiw
Iron binding site 7 out
of 8 in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 7 of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Fe142
b:9.1
occ:1.00
|
FE
|
G:HEM142
|
0.0
|
9.1
|
1.0
|
ND
|
G:HEM142
|
2.1
|
9.8
|
1.0
|
NC
|
G:HEM142
|
2.1
|
10.1
|
1.0
|
NA
|
G:HEM142
|
2.2
|
9.6
|
1.0
|
NB
|
G:HEM142
|
2.2
|
8.9
|
1.0
|
NE2
|
G:HIS87
|
2.3
|
9.3
|
1.0
|
CE1
|
G:HIS87
|
3.1
|
8.6
|
1.0
|
C1D
|
G:HEM142
|
3.1
|
9.4
|
1.0
|
C4D
|
G:HEM142
|
3.1
|
10.2
|
1.0
|
C4C
|
G:HEM142
|
3.2
|
9.9
|
1.0
|
C1C
|
G:HEM142
|
3.2
|
9.4
|
1.0
|
C1A
|
G:HEM142
|
3.2
|
11.5
|
1.0
|
C4B
|
G:HEM142
|
3.2
|
8.3
|
1.0
|
C4A
|
G:HEM142
|
3.2
|
10.5
|
1.0
|
C1B
|
G:HEM142
|
3.2
|
8.9
|
1.0
|
O
|
G:HOH252
|
3.3
|
25.4
|
1.0
|
CD2
|
G:HIS87
|
3.4
|
8.5
|
1.0
|
CHD
|
G:HEM142
|
3.5
|
8.6
|
1.0
|
CHC
|
G:HEM142
|
3.5
|
9.2
|
1.0
|
CHA
|
G:HEM142
|
3.5
|
11.1
|
1.0
|
CHB
|
G:HEM142
|
3.6
|
10.1
|
1.0
|
ND1
|
G:HIS87
|
4.3
|
9.5
|
1.0
|
CE1
|
G:HIS58
|
4.3
|
14.6
|
1.0
|
C2D
|
G:HEM142
|
4.4
|
11.0
|
1.0
|
C3D
|
G:HEM142
|
4.4
|
11.2
|
1.0
|
C3C
|
G:HEM142
|
4.4
|
9.9
|
1.0
|
C2C
|
G:HEM142
|
4.4
|
8.4
|
1.0
|
C3A
|
G:HEM142
|
4.4
|
10.9
|
1.0
|
C2A
|
G:HEM142
|
4.4
|
13.4
|
1.0
|
C3B
|
G:HEM142
|
4.4
|
9.8
|
1.0
|
C2B
|
G:HEM142
|
4.4
|
9.7
|
1.0
|
CG
|
G:HIS87
|
4.5
|
8.5
|
1.0
|
NE2
|
G:HIS58
|
4.5
|
16.3
|
1.0
|
CD1
|
G:LEU91
|
4.6
|
10.3
|
1.0
|
|
Iron binding site 8 out
of 8 in 1uiw
Go back to
Iron Binding Sites List in 1uiw
Iron binding site 8 out
of 8 in the Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2
Mono view
Stereo pair view
|
A full contact list of Iron with other atoms in the Fe binding
site number 8 of Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Fe147
b:6.5
occ:1.00
|
FE
|
H:HEM147
|
0.0
|
6.5
|
1.0
|
ND
|
H:HEM147
|
2.1
|
7.7
|
1.0
|
NB
|
H:HEM147
|
2.1
|
7.4
|
1.0
|
NA
|
H:HEM147
|
2.1
|
5.0
|
1.0
|
NC
|
H:HEM147
|
2.1
|
5.5
|
1.0
|
NE2
|
H:HIS92
|
2.3
|
6.6
|
1.0
|
C4B
|
H:HEM147
|
3.1
|
4.8
|
1.0
|
C1A
|
H:HEM147
|
3.1
|
6.8
|
1.0
|
C4D
|
H:HEM147
|
3.1
|
6.9
|
1.0
|
C1C
|
H:HEM147
|
3.1
|
5.5
|
1.0
|
C1D
|
H:HEM147
|
3.1
|
7.0
|
1.0
|
C1B
|
H:HEM147
|
3.2
|
6.6
|
1.0
|
C4C
|
H:HEM147
|
3.2
|
7.3
|
1.0
|
CE1
|
H:HIS92
|
3.2
|
7.8
|
1.0
|
C4A
|
H:HEM147
|
3.2
|
6.5
|
1.0
|
CD2
|
H:HIS92
|
3.3
|
6.1
|
1.0
|
CHA
|
H:HEM147
|
3.5
|
7.5
|
1.0
|
CHC
|
H:HEM147
|
3.5
|
6.0
|
1.0
|
CHB
|
H:HEM147
|
3.5
|
6.4
|
1.0
|
CHD
|
H:HEM147
|
3.5
|
7.2
|
1.0
|
CG2
|
H:VAL67
|
4.2
|
9.8
|
1.0
|
NE2
|
H:HIS63
|
4.3
|
9.2
|
1.0
|
ND1
|
H:HIS92
|
4.3
|
7.7
|
1.0
|
C3B
|
H:HEM147
|
4.3
|
7.2
|
1.0
|
C2B
|
H:HEM147
|
4.4
|
5.4
|
1.0
|
C2C
|
H:HEM147
|
4.4
|
5.3
|
1.0
|
C2D
|
H:HEM147
|
4.4
|
7.2
|
1.0
|
C2A
|
H:HEM147
|
4.4
|
7.4
|
1.0
|
C3C
|
H:HEM147
|
4.4
|
6.4
|
1.0
|
C3A
|
H:HEM147
|
4.4
|
6.6
|
1.0
|
C3D
|
H:HEM147
|
4.4
|
8.1
|
1.0
|
CG
|
H:HIS92
|
4.5
|
6.4
|
1.0
|
|
Reference:
S.-Y.Park,
N.Shibayama,
T.Hiraki,
J.R.H.Tame.
Crystal Structures of Unliganded and Half-Liganded Human Hemoglobin Derivatives Cross-Linked Between Lys 82BETA1 and Lys 82BETA2 Biochemistry V. 43 8711 2004.
ISSN: ISSN 0006-2960
PubMed: 15236579
DOI: 10.1021/BI049932W
Page generated: Sat Aug 3 15:52:57 2024
|