Cadmium in PDB 1ji9: Solution Structure of the Alpha-Domain of Mouse Metallothionein-3
Cadmium Binding Sites:
The binding sites of Cadmium atom in the Solution Structure of the Alpha-Domain of Mouse Metallothionein-3
(pdb code 1ji9). This binding sites where shown within
5.0 Angstroms radius around Cadmium atom.
In total 4 binding sites of Cadmium where determined in the
Solution Structure of the Alpha-Domain of Mouse Metallothionein-3, PDB code: 1ji9:
Jump to Cadmium binding site number:
1;
2;
3;
4;
Cadmium binding site 1 out
of 4 in 1ji9
Go back to
Cadmium Binding Sites List in 1ji9
Cadmium binding site 1 out
of 4 in the Solution Structure of the Alpha-Domain of Mouse Metallothionein-3
Mono view
Stereo pair view
|
A full contact list of Cadmium with other atoms in the Cd binding
site number 1 of Solution Structure of the Alpha-Domain of Mouse Metallothionein-3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cd69
b:0.4
occ:1.00
|
HG
|
A:CYS51
|
1.6
|
1.3
|
1.0
|
HG
|
A:CYS67
|
2.1
|
0.8
|
1.0
|
SG
|
A:CYS67
|
2.5
|
0.4
|
1.0
|
SG
|
A:CYS51
|
2.5
|
0.7
|
1.0
|
SG
|
A:CYS64
|
2.5
|
0.6
|
1.0
|
SG
|
A:CYS66
|
2.5
|
1.1
|
1.0
|
HG
|
A:CYS64
|
2.5
|
0.9
|
1.0
|
H
|
A:CYS67
|
2.7
|
0.5
|
1.0
|
HG
|
A:CYS66
|
2.9
|
1.0
|
1.0
|
HB2
|
A:CYS64
|
3.1
|
0.5
|
1.0
|
H
|
A:CYS66
|
3.3
|
0.5
|
1.0
|
HG22
|
A:VAL50
|
3.4
|
1.0
|
1.0
|
CB
|
A:CYS64
|
3.4
|
0.4
|
1.0
|
HG
|
A:CYS38
|
3.4
|
0.9
|
1.0
|
HB2
|
A:CYS67
|
3.4
|
0.5
|
1.0
|
HB3
|
A:CYS51
|
3.4
|
1.2
|
1.0
|
N
|
A:CYS67
|
3.5
|
0.5
|
1.0
|
CD
|
A:CD72
|
3.6
|
0.4
|
1.0
|
HB2
|
A:CYS66
|
3.6
|
0.9
|
1.0
|
CB
|
A:CYS67
|
3.6
|
0.5
|
1.0
|
CD
|
A:CD71
|
3.6
|
0.3
|
1.0
|
CB
|
A:CYS51
|
3.6
|
0.6
|
1.0
|
CB
|
A:CYS66
|
3.6
|
0.5
|
1.0
|
HB3
|
A:CYS64
|
3.7
|
0.4
|
1.0
|
SG
|
A:CYS38
|
3.9
|
0.3
|
1.0
|
HG21
|
A:VAL50
|
3.9
|
1.0
|
1.0
|
HG
|
A:CYS37
|
3.9
|
0.9
|
1.0
|
N
|
A:CYS66
|
4.1
|
0.5
|
1.0
|
CG2
|
A:VAL50
|
4.1
|
0.5
|
1.0
|
CA
|
A:CYS66
|
4.2
|
0.6
|
1.0
|
CA
|
A:CYS67
|
4.3
|
0.5
|
1.0
|
C
|
A:CYS66
|
4.3
|
0.5
|
1.0
|
HB2
|
A:CYS51
|
4.4
|
1.1
|
1.0
|
H
|
A:SER65
|
4.5
|
0.5
|
1.0
|
HB3
|
A:CYS67
|
4.5
|
0.7
|
1.0
|
H
|
A:CYS51
|
4.5
|
0.5
|
1.0
|
HB3
|
A:CYS66
|
4.6
|
0.9
|
1.0
|
N
|
A:CYS51
|
4.6
|
0.5
|
1.0
|
CA
|
A:CYS51
|
4.6
|
0.5
|
1.0
|
HB2
|
A:CYS37
|
4.6
|
0.3
|
1.0
|
CA
|
A:CYS64
|
4.7
|
0.5
|
1.0
|
H
|
A:GLN68
|
4.7
|
0.7
|
1.0
|
HA
|
A:CYS67
|
4.8
|
0.5
|
1.0
|
HG23
|
A:VAL50
|
4.8
|
1.0
|
1.0
|
HG
|
A:CYS45
|
4.8
|
0.7
|
1.0
|
HA
|
A:CYS51
|
4.8
|
0.7
|
1.0
|
N
|
A:SER65
|
4.8
|
0.5
|
1.0
|
HG
|
A:CYS42
|
4.8
|
0.9
|
1.0
|
HB3
|
A:LYS44
|
4.9
|
0.4
|
1.0
|
SG
|
A:CYS37
|
4.9
|
0.4
|
1.0
|
HB
|
A:VAL50
|
4.9
|
0.6
|
1.0
|
|
Cadmium binding site 2 out
of 4 in 1ji9
Go back to
Cadmium Binding Sites List in 1ji9
Cadmium binding site 2 out
of 4 in the Solution Structure of the Alpha-Domain of Mouse Metallothionein-3
Mono view
Stereo pair view
|
A full contact list of Cadmium with other atoms in the Cd binding
site number 2 of Solution Structure of the Alpha-Domain of Mouse Metallothionein-3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cd70
b:0.4
occ:1.00
|
HG
|
A:CYS35
|
2.1
|
1.3
|
1.0
|
SG
|
A:CYS35
|
2.5
|
0.6
|
1.0
|
SG
|
A:CYS49
|
2.5
|
0.5
|
1.0
|
SG
|
A:CYS45
|
2.5
|
0.3
|
1.0
|
SG
|
A:CYS34
|
2.5
|
0.6
|
1.0
|
HG
|
A:CYS49
|
2.7
|
1.0
|
1.0
|
O
|
A:CYS34
|
2.9
|
0.5
|
1.0
|
HA
|
A:CYS49
|
3.0
|
0.3
|
1.0
|
HG
|
A:CYS45
|
3.1
|
0.7
|
1.0
|
HB3
|
A:CYS45
|
3.1
|
0.2
|
1.0
|
HB2
|
A:CYS35
|
3.2
|
1.5
|
1.0
|
HG
|
A:CYS34
|
3.3
|
1.1
|
1.0
|
CB
|
A:CYS45
|
3.4
|
0.2
|
1.0
|
CB
|
A:CYS35
|
3.5
|
0.8
|
1.0
|
CB
|
A:CYS49
|
3.6
|
0.4
|
1.0
|
C
|
A:CYS34
|
3.7
|
0.5
|
1.0
|
HB2
|
A:CYS34
|
3.7
|
1.5
|
1.0
|
HB2
|
A:CYS38
|
3.7
|
0.3
|
1.0
|
CA
|
A:CYS49
|
3.7
|
0.4
|
1.0
|
CB
|
A:CYS34
|
3.8
|
0.8
|
1.0
|
CD
|
A:CD72
|
3.9
|
0.4
|
1.0
|
HB2
|
A:CYS49
|
3.9
|
0.4
|
1.0
|
HG
|
A:CYS38
|
4.0
|
0.9
|
1.0
|
HB2
|
A:CYS45
|
4.0
|
0.2
|
1.0
|
H
|
A:CYS51
|
4.1
|
0.5
|
1.0
|
SG
|
A:CYS51
|
4.2
|
0.7
|
1.0
|
O
|
A:SER33
|
4.2
|
1.9
|
1.0
|
HB3
|
A:CYS35
|
4.2
|
1.5
|
1.0
|
CD
|
A:CD71
|
4.2
|
0.3
|
1.0
|
CA
|
A:CYS34
|
4.4
|
0.6
|
1.0
|
N
|
A:CYS35
|
4.4
|
0.5
|
1.0
|
CB
|
A:CYS38
|
4.5
|
0.2
|
1.0
|
CA
|
A:CYS35
|
4.5
|
0.5
|
1.0
|
C
|
A:CYS49
|
4.5
|
0.4
|
1.0
|
HB3
|
A:CYS38
|
4.5
|
0.3
|
1.0
|
HA
|
A:CYS35
|
4.6
|
0.6
|
1.0
|
HA
|
A:CYS45
|
4.6
|
0.2
|
1.0
|
HB3
|
A:CYS49
|
4.6
|
0.5
|
1.0
|
H
|
A:VAL50
|
4.6
|
0.5
|
1.0
|
CA
|
A:CYS45
|
4.6
|
0.2
|
1.0
|
HB3
|
A:CYS34
|
4.6
|
1.4
|
1.0
|
SG
|
A:CYS38
|
4.7
|
0.3
|
1.0
|
N
|
A:VAL50
|
4.9
|
0.4
|
1.0
|
N
|
A:CYS49
|
4.9
|
0.4
|
1.0
|
HB3
|
A:CYS42
|
4.9
|
0.2
|
1.0
|
HG
|
A:CYS51
|
5.0
|
1.3
|
1.0
|
HG22
|
A:VAL50
|
5.0
|
1.0
|
1.0
|
HB2
|
A:CYS51
|
5.0
|
1.1
|
1.0
|
N
|
A:CYS51
|
5.0
|
0.5
|
1.0
|
|
Cadmium binding site 3 out
of 4 in 1ji9
Go back to
Cadmium Binding Sites List in 1ji9
Cadmium binding site 3 out
of 4 in the Solution Structure of the Alpha-Domain of Mouse Metallothionein-3
Mono view
Stereo pair view
|
A full contact list of Cadmium with other atoms in the Cd binding
site number 3 of Solution Structure of the Alpha-Domain of Mouse Metallothionein-3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cd71
b:0.3
occ:1.00
|
HG
|
A:CYS42
|
1.7
|
0.9
|
1.0
|
HG
|
A:CYS67
|
1.9
|
0.8
|
1.0
|
HG
|
A:CYS38
|
2.0
|
0.9
|
1.0
|
SG
|
A:CYS38
|
2.5
|
0.3
|
1.0
|
SG
|
A:CYS42
|
2.5
|
0.3
|
1.0
|
SG
|
A:CYS67
|
2.5
|
0.4
|
1.0
|
SG
|
A:CYS45
|
2.5
|
0.3
|
1.0
|
HG
|
A:CYS45
|
2.9
|
0.7
|
1.0
|
HB2
|
A:LYS44
|
2.9
|
0.5
|
1.0
|
HB3
|
A:CYS38
|
3.1
|
0.3
|
1.0
|
CB
|
A:CYS38
|
3.4
|
0.2
|
1.0
|
HB3
|
A:CYS42
|
3.4
|
0.2
|
1.0
|
HG22
|
A:VAL50
|
3.4
|
1.0
|
1.0
|
HB2
|
A:CYS45
|
3.4
|
0.2
|
1.0
|
HB3
|
A:CYS67
|
3.5
|
0.7
|
1.0
|
CB
|
A:CYS67
|
3.5
|
0.5
|
1.0
|
CB
|
A:CYS42
|
3.5
|
0.3
|
1.0
|
HG
|
A:CYS51
|
3.5
|
1.3
|
1.0
|
CD
|
A:CD69
|
3.6
|
0.4
|
1.0
|
HG23
|
A:VAL50
|
3.6
|
1.0
|
1.0
|
CB
|
A:CYS45
|
3.6
|
0.2
|
1.0
|
CD
|
A:CD72
|
3.6
|
0.4
|
1.0
|
SG
|
A:CYS51
|
3.7
|
0.7
|
1.0
|
HB2
|
A:CYS67
|
3.7
|
0.5
|
1.0
|
HB3
|
A:LYS44
|
3.7
|
0.4
|
1.0
|
HB2
|
A:CYS38
|
3.8
|
0.3
|
1.0
|
CB
|
A:LYS44
|
3.8
|
0.3
|
1.0
|
HG21
|
A:VAL50
|
3.8
|
1.0
|
1.0
|
CG2
|
A:VAL50
|
3.8
|
0.5
|
1.0
|
HB2
|
A:CYS42
|
3.9
|
0.3
|
1.0
|
HG
|
A:CYS35
|
4.0
|
1.3
|
1.0
|
H
|
A:CYS45
|
4.0
|
0.2
|
1.0
|
N
|
A:CYS45
|
4.1
|
0.2
|
1.0
|
CD
|
A:CD70
|
4.2
|
0.4
|
1.0
|
CA
|
A:CYS45
|
4.4
|
0.2
|
1.0
|
HB3
|
A:CYS45
|
4.5
|
0.2
|
1.0
|
C
|
A:LYS44
|
4.5
|
0.3
|
1.0
|
SG
|
A:CYS64
|
4.6
|
0.6
|
1.0
|
HG
|
A:CYS64
|
4.6
|
0.9
|
1.0
|
HA
|
A:CYS45
|
4.6
|
0.2
|
1.0
|
H
|
A:LYS44
|
4.7
|
0.3
|
1.0
|
HG3
|
A:LYS44
|
4.7
|
0.4
|
1.0
|
CA
|
A:CYS38
|
4.7
|
0.2
|
1.0
|
H
|
A:VAL50
|
4.7
|
0.5
|
1.0
|
HA
|
A:CYS38
|
4.7
|
0.3
|
1.0
|
H
|
A:CYS51
|
4.7
|
0.5
|
1.0
|
CA
|
A:LYS44
|
4.7
|
0.3
|
1.0
|
CG
|
A:LYS44
|
4.8
|
0.4
|
1.0
|
CA
|
A:CYS42
|
4.8
|
0.3
|
1.0
|
CA
|
A:CYS67
|
4.9
|
0.5
|
1.0
|
H
|
A:CYS67
|
4.9
|
0.5
|
1.0
|
SG
|
A:CYS35
|
4.9
|
0.6
|
1.0
|
HD2
|
A:PRO39
|
4.9
|
0.3
|
1.0
|
HA
|
A:CYS49
|
5.0
|
0.3
|
1.0
|
|
Cadmium binding site 4 out
of 4 in 1ji9
Go back to
Cadmium Binding Sites List in 1ji9
Cadmium binding site 4 out
of 4 in the Solution Structure of the Alpha-Domain of Mouse Metallothionein-3
Mono view
Stereo pair view
|
A full contact list of Cadmium with other atoms in the Cd binding
site number 4 of Solution Structure of the Alpha-Domain of Mouse Metallothionein-3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cd72
b:0.4
occ:1.00
|
HG
|
A:CYS37
|
1.7
|
0.9
|
1.0
|
HG
|
A:CYS38
|
1.9
|
0.9
|
1.0
|
HG
|
A:CYS35
|
1.9
|
1.3
|
1.0
|
SG
|
A:CYS35
|
2.5
|
0.6
|
1.0
|
SG
|
A:CYS38
|
2.5
|
0.3
|
1.0
|
SG
|
A:CYS51
|
2.5
|
0.7
|
1.0
|
SG
|
A:CYS37
|
2.5
|
0.4
|
1.0
|
HG
|
A:CYS51
|
2.7
|
1.3
|
1.0
|
HB3
|
A:CYS35
|
3.1
|
1.5
|
1.0
|
HB2
|
A:CYS38
|
3.2
|
0.3
|
1.0
|
CB
|
A:CYS35
|
3.4
|
0.8
|
1.0
|
HB2
|
A:CYS51
|
3.4
|
1.1
|
1.0
|
CB
|
A:CYS38
|
3.5
|
0.2
|
1.0
|
CD
|
A:CD69
|
3.6
|
0.4
|
1.0
|
CB
|
A:CYS51
|
3.6
|
0.6
|
1.0
|
SG
|
A:CYS64
|
3.6
|
0.6
|
1.0
|
CD
|
A:CD71
|
3.6
|
0.3
|
1.0
|
HB2
|
A:CYS37
|
3.7
|
0.3
|
1.0
|
H
|
A:CYS37
|
3.7
|
0.3
|
1.0
|
CB
|
A:CYS37
|
3.7
|
0.4
|
1.0
|
CD
|
A:CD70
|
3.9
|
0.4
|
1.0
|
H
|
A:CYS38
|
3.9
|
0.3
|
1.0
|
N
|
A:CYS38
|
3.9
|
0.2
|
1.0
|
HG
|
A:CYS67
|
3.9
|
0.8
|
1.0
|
HB2
|
A:CYS35
|
3.9
|
1.5
|
1.0
|
HB3
|
A:CYS64
|
4.0
|
0.4
|
1.0
|
HB3
|
A:CYS51
|
4.0
|
1.2
|
1.0
|
C
|
A:CYS37
|
4.0
|
0.2
|
1.0
|
CA
|
A:CYS37
|
4.2
|
0.3
|
1.0
|
HB3
|
A:CYS38
|
4.3
|
0.3
|
1.0
|
SG
|
A:CYS45
|
4.3
|
0.3
|
1.0
|
N
|
A:CYS37
|
4.3
|
0.3
|
1.0
|
HG
|
A:CYS64
|
4.4
|
0.9
|
1.0
|
CB
|
A:CYS64
|
4.4
|
0.4
|
1.0
|
CA
|
A:CYS38
|
4.4
|
0.2
|
1.0
|
O
|
A:CYS37
|
4.5
|
0.3
|
1.0
|
H
|
A:CYS51
|
4.6
|
0.5
|
1.0
|
HG
|
A:CYS45
|
4.6
|
0.7
|
1.0
|
HB3
|
A:CYS37
|
4.6
|
0.4
|
1.0
|
HB3
|
A:ALA59
|
4.6
|
1.4
|
1.0
|
H
|
A:SER36
|
4.7
|
0.7
|
1.0
|
HA
|
A:CYS35
|
4.7
|
0.6
|
1.0
|
CA
|
A:CYS35
|
4.7
|
0.5
|
1.0
|
HG
|
A:CYS49
|
4.8
|
1.0
|
1.0
|
HG22
|
A:VAL50
|
4.8
|
1.0
|
1.0
|
HG
|
A:CYS42
|
4.8
|
0.9
|
1.0
|
SG
|
A:CYS67
|
4.9
|
0.4
|
1.0
|
CA
|
A:CYS51
|
4.9
|
0.5
|
1.0
|
HB2
|
A:CYS64
|
4.9
|
0.5
|
1.0
|
HA
|
A:CYS38
|
5.0
|
0.3
|
1.0
|
HA
|
A:ALA59
|
5.0
|
0.9
|
1.0
|
|
Reference:
G.Oz,
K.Zangger,
I.M.Armitage.
Three-Dimensional Structure and Dynamics of A Brain Specific Growth Inhibitory Factor: Metallothionein-3. Biochemistry V. 40 11433 2001.
ISSN: ISSN 0006-2960
PubMed: 11560491
DOI: 10.1021/BI010827L
Page generated: Fri Jul 19 13:39:20 2024
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