Cadmium in PDB 2f5h: Solution Structure of the Alpha-Domain of Human Metallothionein-3
Cadmium Binding Sites:
The binding sites of Cadmium atom in the Solution Structure of the Alpha-Domain of Human Metallothionein-3
(pdb code 2f5h). 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 Human Metallothionein-3, PDB code: 2f5h:
Jump to Cadmium binding site number:
1;
2;
3;
4;
Cadmium binding site 1 out
of 4 in 2f5h
Go back to
Cadmium Binding Sites List in 2f5h
Cadmium binding site 1 out
of 4 in the Solution Structure of the Alpha-Domain of Human 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 Human Metallothionein-3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cd69
b:0.1
occ:1.00
|
SG
|
A:CYS34
|
2.7
|
41.2
|
1.0
|
SG
|
A:CYS35
|
2.7
|
72.1
|
1.0
|
SG
|
A:CYS49
|
2.7
|
13.2
|
1.0
|
SG
|
A:CYS45
|
2.8
|
62.5
|
1.0
|
HB3
|
A:CYS45
|
3.0
|
1.3
|
1.0
|
HA
|
A:CYS49
|
3.1
|
23.1
|
1.0
|
HB3
|
A:CYS35
|
3.3
|
3.4
|
1.0
|
HB2
|
A:CYS49
|
3.4
|
4.3
|
1.0
|
O
|
A:CYS34
|
3.4
|
23.2
|
1.0
|
CB
|
A:CYS45
|
3.5
|
13.4
|
1.0
|
CB
|
A:CYS49
|
3.5
|
74.4
|
1.0
|
HB2
|
A:CYS34
|
3.6
|
34.4
|
1.0
|
CB
|
A:CYS35
|
3.6
|
64.2
|
1.0
|
C
|
A:CYS34
|
3.7
|
73.2
|
1.0
|
CB
|
A:CYS34
|
3.7
|
22.2
|
1.0
|
CA
|
A:CYS49
|
3.8
|
44.4
|
1.0
|
H
|
A:CYS34
|
4.0
|
12.5
|
1.0
|
HB2
|
A:CYS45
|
4.0
|
40.3
|
1.0
|
SG
|
A:CYS51
|
4.1
|
52.1
|
1.0
|
CD
|
A:CD70
|
4.1
|
53.2
|
1.0
|
CA
|
A:CYS34
|
4.2
|
64.5
|
1.0
|
N
|
A:CYS35
|
4.2
|
4.1
|
1.0
|
HB2
|
A:CYS38
|
4.3
|
13.2
|
1.0
|
HB2
|
A:CYS35
|
4.4
|
44.5
|
1.0
|
N
|
A:CYS34
|
4.5
|
2.3
|
1.0
|
HB3
|
A:CYS49
|
4.5
|
15.1
|
1.0
|
CA
|
A:CYS35
|
4.6
|
61.4
|
1.0
|
HB2
|
A:CYS51
|
4.6
|
22.1
|
1.0
|
H
|
A:VAL50
|
4.6
|
34.3
|
1.0
|
HA
|
A:CYS45
|
4.7
|
42.4
|
1.0
|
HB3
|
A:CYS34
|
4.7
|
22.1
|
1.0
|
CA
|
A:CYS45
|
4.7
|
43.2
|
1.0
|
C
|
A:CYS49
|
4.8
|
50.2
|
1.0
|
H
|
A:CYS35
|
4.8
|
34.3
|
1.0
|
N
|
A:CYS49
|
4.8
|
31.4
|
1.0
|
|
Cadmium binding site 2 out
of 4 in 2f5h
Go back to
Cadmium Binding Sites List in 2f5h
Cadmium binding site 2 out
of 4 in the Solution Structure of the Alpha-Domain of Human 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 Human Metallothionein-3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cd70
b:53.2
occ:1.00
|
SG
|
A:CYS37
|
2.7
|
32.1
|
1.0
|
SG
|
A:CYS51
|
2.7
|
52.1
|
1.0
|
SG
|
A:CYS38
|
2.8
|
14.0
|
1.0
|
SG
|
A:CYS35
|
2.8
|
72.1
|
1.0
|
HB2
|
A:CYS38
|
3.0
|
13.2
|
1.0
|
HB2
|
A:CYS35
|
3.1
|
44.5
|
1.0
|
CB
|
A:CYS38
|
3.4
|
14.4
|
1.0
|
CB
|
A:CYS35
|
3.5
|
64.2
|
1.0
|
H
|
A:CYS37
|
3.5
|
11.2
|
1.0
|
HB3
|
A:CYS51
|
3.7
|
71.3
|
1.0
|
HB3
|
A:CYS35
|
3.7
|
3.4
|
1.0
|
HB2
|
A:CYS37
|
3.7
|
65.1
|
1.0
|
CB
|
A:CYS51
|
3.7
|
5.5
|
1.0
|
CB
|
A:CYS37
|
3.7
|
23.2
|
1.0
|
N
|
A:CYS38
|
3.7
|
31.4
|
1.0
|
H
|
A:CYS38
|
3.8
|
55.4
|
1.0
|
C
|
A:CYS37
|
3.8
|
44.3
|
1.0
|
HB2
|
A:CYS51
|
3.9
|
22.1
|
1.0
|
SG
|
A:CYS64
|
4.0
|
65.4
|
1.0
|
CD
|
A:CD72
|
4.0
|
33.4
|
1.0
|
CD
|
A:CD69
|
4.1
|
0.1
|
1.0
|
CA
|
A:CYS37
|
4.1
|
52.4
|
1.0
|
N
|
A:CYS37
|
4.2
|
35.5
|
1.0
|
CD
|
A:CD71
|
4.2
|
43.2
|
1.0
|
CA
|
A:CYS38
|
4.2
|
73.0
|
1.0
|
O
|
A:CYS37
|
4.3
|
24.3
|
1.0
|
HB3
|
A:CYS38
|
4.3
|
11.1
|
1.0
|
SG
|
A:CYS45
|
4.3
|
62.5
|
1.0
|
HB3
|
A:CYS64
|
4.6
|
51.5
|
1.0
|
H
|
A:SER36
|
4.7
|
1.1
|
1.0
|
HB3
|
A:CYS37
|
4.7
|
3.3
|
1.0
|
HA
|
A:CYS38
|
4.9
|
13.4
|
1.0
|
CA
|
A:CYS35
|
4.9
|
61.4
|
1.0
|
CB
|
A:CYS64
|
5.0
|
0.2
|
1.0
|
|
Cadmium binding site 3 out
of 4 in 2f5h
Go back to
Cadmium Binding Sites List in 2f5h
Cadmium binding site 3 out
of 4 in the Solution Structure of the Alpha-Domain of Human 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 Human Metallothionein-3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cd71
b:43.2
occ:1.00
|
SG
|
A:CYS45
|
2.8
|
62.5
|
1.0
|
SG
|
A:CYS42
|
2.8
|
54.1
|
1.0
|
SG
|
A:CYS38
|
2.8
|
14.0
|
1.0
|
SG
|
A:CYS67
|
2.8
|
4.2
|
1.0
|
HB3
|
A:CYS38
|
3.2
|
11.1
|
1.0
|
HB3
|
A:CYS67
|
3.3
|
51.5
|
1.0
|
HB2
|
A:LYS44
|
3.3
|
43.3
|
1.0
|
HB2
|
A:CYS67
|
3.4
|
44.3
|
1.0
|
CB
|
A:CYS67
|
3.4
|
51.3
|
1.0
|
HB2
|
A:CYS45
|
3.4
|
40.3
|
1.0
|
CB
|
A:CYS38
|
3.5
|
14.4
|
1.0
|
HB2
|
A:CYS38
|
3.6
|
13.2
|
1.0
|
H
|
A:CYS45
|
3.6
|
40.4
|
1.0
|
HB3
|
A:CYS42
|
3.6
|
75.2
|
1.0
|
CB
|
A:CYS45
|
3.7
|
13.4
|
1.0
|
CB
|
A:CYS42
|
3.8
|
73.5
|
1.0
|
CD
|
A:CD72
|
3.9
|
33.4
|
1.0
|
HB2
|
A:CYS42
|
3.9
|
23.2
|
1.0
|
HB3
|
A:LYS44
|
4.0
|
0.4
|
1.0
|
N
|
A:CYS45
|
4.0
|
43.5
|
1.0
|
CB
|
A:LYS44
|
4.1
|
3.3
|
1.0
|
SG
|
A:CYS51
|
4.2
|
52.1
|
1.0
|
CD
|
A:CD70
|
4.2
|
53.2
|
1.0
|
HG21
|
A:VAL50
|
4.4
|
0.5
|
1.0
|
CA
|
A:CYS45
|
4.5
|
43.2
|
1.0
|
HB3
|
A:CYS45
|
4.6
|
1.3
|
1.0
|
C
|
A:LYS44
|
4.7
|
1.3
|
1.0
|
HD2
|
A:PRO39
|
4.7
|
1.0
|
1.0
|
H
|
A:LYS44
|
4.7
|
61.2
|
1.0
|
HA
|
A:CYS45
|
4.8
|
42.4
|
1.0
|
CA
|
A:LYS44
|
4.9
|
71.1
|
1.0
|
SG
|
A:CYS64
|
4.9
|
65.4
|
1.0
|
CA
|
A:CYS67
|
4.9
|
14.6
|
1.0
|
CA
|
A:CYS38
|
5.0
|
73.0
|
1.0
|
HG23
|
A:VAL50
|
5.0
|
70.0
|
1.0
|
|
Cadmium binding site 4 out
of 4 in 2f5h
Go back to
Cadmium Binding Sites List in 2f5h
Cadmium binding site 4 out
of 4 in the Solution Structure of the Alpha-Domain of Human 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 Human Metallothionein-3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cd72
b:33.4
occ:1.00
|
SG
|
A:CYS66
|
2.7
|
63.1
|
1.0
|
SG
|
A:CYS51
|
2.7
|
52.1
|
1.0
|
SG
|
A:CYS67
|
2.8
|
4.2
|
1.0
|
SG
|
A:CYS64
|
2.9
|
65.4
|
1.0
|
HB2
|
A:CYS67
|
2.9
|
44.3
|
1.0
|
HB2
|
A:CYS64
|
2.9
|
1.2
|
1.0
|
H
|
A:CYS67
|
3.2
|
44.5
|
1.0
|
CB
|
A:CYS67
|
3.4
|
51.3
|
1.0
|
CB
|
A:CYS64
|
3.4
|
0.2
|
1.0
|
HB2
|
A:CYS66
|
3.6
|
14.1
|
1.0
|
HA
|
A:CYS51
|
3.6
|
14.2
|
1.0
|
N
|
A:CYS67
|
3.6
|
71.0
|
1.0
|
HB3
|
A:CYS51
|
3.6
|
71.3
|
1.0
|
CB
|
A:CYS51
|
3.7
|
5.5
|
1.0
|
CB
|
A:CYS66
|
3.8
|
20.3
|
1.0
|
HB3
|
A:CYS64
|
3.8
|
51.5
|
1.0
|
HG21
|
A:VAL50
|
3.8
|
0.5
|
1.0
|
CD
|
A:CD71
|
3.9
|
43.2
|
1.0
|
CD
|
A:CD70
|
4.0
|
53.2
|
1.0
|
O
|
A:VAL50
|
4.0
|
30.0
|
1.0
|
SG
|
A:CYS38
|
4.1
|
14.0
|
1.0
|
CA
|
A:CYS51
|
4.1
|
24.0
|
1.0
|
CA
|
A:CYS67
|
4.1
|
14.6
|
1.0
|
C
|
A:CYS66
|
4.2
|
52.1
|
1.0
|
HB3
|
A:CYS67
|
4.3
|
51.5
|
1.0
|
CA
|
A:CYS66
|
4.4
|
32.1
|
1.0
|
C
|
A:VAL50
|
4.5
|
64.2
|
1.0
|
N
|
A:CYS51
|
4.5
|
73.4
|
1.0
|
H
|
A:CYS66
|
4.6
|
1.3
|
1.0
|
HG22
|
A:VAL50
|
4.6
|
11.3
|
1.0
|
HB3
|
A:CYS66
|
4.6
|
35.0
|
1.0
|
N
|
A:CYS66
|
4.6
|
74.3
|
1.0
|
HB2
|
A:CYS51
|
4.7
|
22.1
|
1.0
|
CG2
|
A:VAL50
|
4.7
|
2.1
|
1.0
|
CA
|
A:CYS64
|
4.8
|
42.1
|
1.0
|
HA
|
A:CYS67
|
4.9
|
41.5
|
1.0
|
C
|
A:CYS64
|
5.0
|
64.5
|
1.0
|
|
Reference:
H.Wang,
Q.Zhang,
B.Cai,
H.Y.Li,
K.H.Sze,
Z.X.Huang,
H.M.Wu,
H.Z.Sun.
Solution Structure and Dynamics of Human Metallothionein-3 (Mt-3) Febs Lett. V. 580 795 2006.
ISSN: ISSN 0014-5793
PubMed: 16413543
DOI: 10.1016/J.FEBSLET.2005.12.099
Page generated: Fri Jul 19 14:49:05 2024
|