Silver in PDB 2x17: The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Protein crystallography data
The structure of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I), PDB code: 2x17
was solved by
A.Ilari,
A.Fiorillo,
P.Ceci,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
50.00 /
3.10
|
Space group
|
P 41
|
Cell size a, b, c (Å), α, β, γ (°)
|
157.681,
157.681,
246.437,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
26.014 /
28.338
|
Silver Binding Sites:
Silver binding site 1 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 1 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 1 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
0:Ag1172
b:70.7
occ:1.00
|
NE2
|
0:HIS53
|
2.2
|
67.6
|
1.0
|
SD
|
I:MET170
|
2.2
|
76.9
|
1.0
|
CE1
|
0:HIS53
|
3.1
|
67.0
|
1.0
|
CD2
|
0:HIS53
|
3.2
|
66.9
|
1.0
|
O
|
0:HOH2001
|
3.2
|
45.9
|
1.0
|
CB
|
I:MET170
|
3.2
|
78.6
|
1.0
|
CG
|
I:MET170
|
3.4
|
78.4
|
1.0
|
OE1
|
0:GLU49
|
3.6
|
67.3
|
1.0
|
CE
|
I:MET170
|
3.9
|
78.5
|
1.0
|
OE2
|
0:GLU130
|
3.9
|
76.4
|
1.0
|
CG
|
0:GLU126
|
3.9
|
71.3
|
1.0
|
CH2
|
0:TRP122
|
4.0
|
69.1
|
1.0
|
CB
|
0:GLU49
|
4.2
|
66.2
|
1.0
|
ND1
|
0:HIS53
|
4.3
|
66.8
|
1.0
|
CD
|
0:GLU49
|
4.3
|
67.0
|
1.0
|
CG
|
0:HIS53
|
4.3
|
66.5
|
1.0
|
O
|
0:GLU49
|
4.5
|
66.2
|
1.0
|
CD
|
0:GLU126
|
4.5
|
71.8
|
1.0
|
CA
|
I:MET170
|
4.6
|
78.7
|
1.0
|
OE2
|
0:GLU126
|
4.6
|
72.1
|
1.0
|
CZ3
|
0:TRP122
|
4.7
|
69.1
|
1.0
|
CG
|
0:GLU49
|
4.7
|
66.6
|
1.0
|
O
|
I:MET170
|
4.7
|
79.0
|
1.0
|
CZ2
|
0:TRP122
|
4.8
|
69.0
|
1.0
|
CD
|
0:GLU130
|
4.9
|
76.1
|
1.0
|
C
|
0:GLU49
|
4.9
|
66.2
|
1.0
|
N
|
I:MET170
|
4.9
|
78.4
|
1.0
|
CA
|
0:GLU49
|
5.0
|
66.2
|
1.0
|
C
|
I:MET170
|
5.0
|
79.0
|
1.0
|
|
Silver binding site 2 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 2 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 2 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
1:Ag1173
b:71.0
occ:1.00
|
SD
|
J:MET170
|
2.2
|
76.8
|
1.0
|
NE2
|
1:HIS53
|
2.2
|
67.9
|
1.0
|
O
|
1:HOH2001
|
2.9
|
47.3
|
1.0
|
CG
|
J:MET170
|
3.0
|
78.4
|
1.0
|
CE1
|
1:HIS53
|
3.0
|
67.2
|
1.0
|
OE1
|
1:GLU49
|
3.1
|
67.3
|
1.0
|
CD2
|
1:HIS53
|
3.2
|
67.0
|
1.0
|
CE
|
J:MET170
|
3.7
|
78.4
|
1.0
|
OE2
|
1:GLU126
|
3.7
|
72.2
|
1.0
|
CG
|
1:GLU126
|
3.8
|
71.3
|
1.0
|
CH2
|
1:TRP122
|
4.0
|
69.0
|
1.0
|
CB
|
1:GLU49
|
4.1
|
66.3
|
1.0
|
CD
|
1:GLU49
|
4.1
|
67.1
|
1.0
|
O
|
1:GLU49
|
4.1
|
66.2
|
1.0
|
CD
|
1:GLU126
|
4.1
|
71.9
|
1.0
|
ND1
|
1:HIS53
|
4.2
|
66.9
|
1.0
|
CG
|
1:HIS53
|
4.3
|
66.5
|
1.0
|
CB
|
J:MET170
|
4.4
|
78.7
|
1.0
|
CG
|
1:GLU49
|
4.5
|
66.7
|
1.0
|
OE2
|
1:GLU130
|
4.6
|
76.4
|
1.0
|
CZ3
|
1:TRP122
|
4.7
|
69.0
|
1.0
|
C
|
1:GLU49
|
4.7
|
66.2
|
1.0
|
CA
|
1:GLU49
|
4.8
|
66.2
|
1.0
|
CZ2
|
1:TRP122
|
4.9
|
69.1
|
1.0
|
|
Silver binding site 3 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 3 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 3 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
1:Ag1174
b:56.1
occ:1.00
|
SD
|
O:MET153
|
2.6
|
79.6
|
1.0
|
SD
|
1:MET153
|
2.7
|
79.9
|
1.0
|
SD
|
I:MET153
|
2.9
|
80.0
|
1.0
|
SD
|
7:MET153
|
3.0
|
79.8
|
1.0
|
CE
|
1:MET153
|
3.5
|
80.0
|
1.0
|
CE
|
I:MET153
|
3.5
|
80.1
|
1.0
|
CE
|
7:MET153
|
3.7
|
80.0
|
1.0
|
CG
|
1:MET153
|
3.8
|
80.0
|
1.0
|
CE
|
O:MET153
|
3.8
|
79.9
|
1.0
|
CG
|
O:MET153
|
4.1
|
79.9
|
1.0
|
CG
|
7:MET153
|
4.1
|
79.9
|
1.0
|
CG
|
I:MET153
|
4.2
|
80.0
|
1.0
|
|
Silver binding site 4 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 4 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 4 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
1:Ag1175
b:60.4
occ:1.00
|
CB
|
6:MET1
|
4.0
|
81.9
|
1.0
|
O
|
6:LEU2
|
4.1
|
82.8
|
1.0
|
CG
|
6:MET1
|
4.2
|
81.8
|
1.0
|
SD
|
6:MET1
|
4.7
|
81.8
|
1.0
|
C
|
6:MET1
|
4.9
|
82.1
|
1.0
|
O
|
6:MET1
|
4.9
|
82.1
|
1.0
|
|
Silver binding site 5 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 5 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 5 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
2:Ag1172
b:74.1
occ:1.00
|
NE2
|
2:HIS53
|
2.2
|
68.4
|
1.0
|
SD
|
K:MET170
|
2.2
|
77.4
|
1.0
|
CB
|
K:MET170
|
2.9
|
78.6
|
1.0
|
CG
|
K:MET170
|
3.1
|
78.4
|
1.0
|
O
|
2:HOH2001
|
3.1
|
34.9
|
1.0
|
CE1
|
2:HIS53
|
3.1
|
67.3
|
1.0
|
CD2
|
2:HIS53
|
3.1
|
67.1
|
1.0
|
OE1
|
2:GLU49
|
3.3
|
67.5
|
1.0
|
CG
|
2:GLU126
|
3.8
|
71.4
|
1.0
|
CE
|
K:MET170
|
3.9
|
78.6
|
1.0
|
CH2
|
2:TRP122
|
4.0
|
69.1
|
1.0
|
OE2
|
2:GLU130
|
4.1
|
76.4
|
1.0
|
O
|
2:GLU49
|
4.1
|
66.3
|
1.0
|
ND1
|
2:HIS53
|
4.2
|
67.0
|
1.0
|
CG
|
2:HIS53
|
4.2
|
66.6
|
1.0
|
CD
|
2:GLU49
|
4.2
|
67.2
|
1.0
|
OE2
|
2:GLU126
|
4.3
|
72.2
|
1.0
|
CB
|
2:GLU49
|
4.3
|
66.3
|
1.0
|
CA
|
K:MET170
|
4.3
|
78.7
|
1.0
|
CD
|
2:GLU126
|
4.5
|
71.9
|
1.0
|
CZ3
|
2:TRP122
|
4.6
|
69.1
|
1.0
|
N
|
K:MET170
|
4.7
|
78.4
|
1.0
|
C
|
2:GLU49
|
4.8
|
66.3
|
1.0
|
CG
|
2:GLU49
|
4.8
|
66.7
|
1.0
|
CZ2
|
2:TRP122
|
4.9
|
69.1
|
1.0
|
CA
|
2:GLU49
|
4.9
|
66.3
|
1.0
|
|
Silver binding site 6 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 6 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 6 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
3:Ag1172
b:59.5
occ:1.00
|
SD
|
3:MET153
|
2.8
|
79.7
|
1.0
|
SD
|
Q:MET153
|
2.8
|
79.7
|
1.0
|
SD
|
9:MET153
|
2.9
|
79.8
|
1.0
|
SD
|
K:MET153
|
3.1
|
79.7
|
1.0
|
CE
|
9:MET153
|
3.5
|
80.1
|
1.0
|
CE
|
3:MET153
|
3.5
|
79.9
|
1.0
|
CE
|
Q:MET153
|
3.6
|
80.0
|
1.0
|
CE
|
K:MET153
|
3.8
|
80.0
|
1.0
|
CG
|
3:MET153
|
3.9
|
79.9
|
1.0
|
CG
|
Q:MET153
|
4.1
|
79.9
|
1.0
|
CG
|
9:MET153
|
4.1
|
80.0
|
1.0
|
CG
|
K:MET153
|
4.2
|
79.9
|
1.0
|
|
Silver binding site 7 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 7 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 7 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
3:Ag1173
b:71.5
occ:1.00
|
O
|
3:HOH2002
|
2.2
|
72.6
|
1.0
|
NE2
|
3:HIS53
|
2.2
|
67.9
|
1.0
|
SD
|
L:MET170
|
2.2
|
77.2
|
1.0
|
CE1
|
3:HIS53
|
3.1
|
67.1
|
1.0
|
OE1
|
3:GLU49
|
3.2
|
67.4
|
1.0
|
CD2
|
3:HIS53
|
3.2
|
67.0
|
1.0
|
CB
|
L:MET170
|
3.4
|
78.7
|
1.0
|
CG
|
L:MET170
|
3.4
|
78.5
|
1.0
|
CG
|
3:GLU126
|
3.7
|
71.3
|
1.0
|
CE
|
L:MET170
|
3.8
|
78.4
|
1.0
|
OE2
|
3:GLU126
|
4.0
|
72.1
|
1.0
|
CH2
|
3:TRP122
|
4.0
|
69.0
|
1.0
|
CD
|
3:GLU49
|
4.2
|
67.0
|
1.0
|
CD
|
3:GLU126
|
4.2
|
71.9
|
1.0
|
ND1
|
3:HIS53
|
4.2
|
66.8
|
1.0
|
CB
|
3:GLU49
|
4.2
|
66.3
|
1.0
|
CG
|
3:HIS53
|
4.3
|
66.5
|
1.0
|
OE2
|
3:GLU130
|
4.3
|
76.4
|
1.0
|
O
|
3:GLU49
|
4.4
|
66.2
|
1.0
|
CG
|
3:GLU49
|
4.6
|
66.6
|
1.0
|
CZ3
|
3:TRP122
|
4.7
|
69.1
|
1.0
|
CA
|
L:MET170
|
4.7
|
78.8
|
1.0
|
CZ2
|
3:TRP122
|
4.8
|
69.0
|
1.0
|
N
|
L:MET170
|
4.9
|
78.5
|
1.0
|
C
|
3:GLU49
|
4.9
|
66.2
|
1.0
|
CA
|
3:GLU49
|
4.9
|
66.2
|
1.0
|
|
Silver binding site 8 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 8 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 8 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
3:Ag1174
b:62.5
occ:1.00
|
OH
|
Y:TYR91
|
2.8
|
75.6
|
1.0
|
ND2
|
3:ASN65
|
3.3
|
70.7
|
1.0
|
CB
|
3:MET1
|
3.7
|
82.0
|
1.0
|
CZ
|
Y:TYR91
|
3.8
|
75.6
|
1.0
|
SD
|
3:MET1
|
3.9
|
81.8
|
1.0
|
CB
|
3:ASN65
|
3.9
|
70.4
|
1.0
|
CE2
|
Y:TYR91
|
4.0
|
75.6
|
1.0
|
CG
|
3:ASN65
|
4.0
|
70.5
|
1.0
|
CG
|
3:MET1
|
4.1
|
81.8
|
1.0
|
CE
|
Y:LYS135
|
4.3
|
75.7
|
1.0
|
CA
|
3:MET1
|
4.6
|
82.1
|
1.0
|
N
|
3:MET1
|
4.7
|
82.0
|
1.0
|
|
Silver binding site 9 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 9 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 9 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
4:Ag1173
b:65.2
occ:1.00
|
NE2
|
4:HIS53
|
2.2
|
66.6
|
1.0
|
SD
|
M:MET170
|
2.6
|
78.3
|
1.0
|
CE1
|
4:HIS53
|
2.9
|
66.8
|
1.0
|
O
|
4:HOH2002
|
3.2
|
43.6
|
1.0
|
OE1
|
4:GLU49
|
3.2
|
67.4
|
1.0
|
CD2
|
4:HIS53
|
3.4
|
66.6
|
1.0
|
CG
|
M:MET170
|
3.5
|
78.6
|
1.0
|
CE
|
M:MET170
|
3.6
|
78.8
|
1.0
|
CG
|
4:GLU126
|
3.8
|
71.4
|
1.0
|
CB
|
M:MET170
|
3.9
|
78.5
|
1.0
|
CH2
|
4:TRP122
|
4.0
|
69.1
|
1.0
|
OE2
|
4:GLU130
|
4.0
|
76.4
|
1.0
|
CB
|
4:GLU49
|
4.1
|
66.3
|
1.0
|
ND1
|
4:HIS53
|
4.1
|
66.6
|
1.0
|
CD
|
4:GLU49
|
4.2
|
67.1
|
1.0
|
OE2
|
4:GLU126
|
4.3
|
72.2
|
1.0
|
CG
|
4:HIS53
|
4.4
|
66.3
|
1.0
|
CD
|
4:GLU126
|
4.4
|
72.0
|
1.0
|
CG
|
4:GLU49
|
4.6
|
66.7
|
1.0
|
O
|
4:GLU49
|
4.6
|
66.2
|
1.0
|
CZ2
|
4:TRP122
|
4.7
|
69.1
|
1.0
|
CZ3
|
4:TRP122
|
4.8
|
69.1
|
1.0
|
CA
|
4:GLU49
|
4.9
|
66.2
|
1.0
|
C
|
4:GLU49
|
5.0
|
66.2
|
1.0
|
|
Silver binding site 10 out
of 33 in 2x17
Go back to
Silver Binding Sites List in 2x17
Silver binding site 10 out
of 33 in the The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I)
Mono view
Stereo pair view
|
A full contact list of Silver with other atoms in the Ag binding
site number 10 of The X-Ray Structure of Ferritin From Pyrococcus Furiosus Loaded with Ag(I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
4:Ag1174
b:56.1
occ:1.00
|
SD
|
Z:MET153
|
2.7
|
79.7
|
1.0
|
SD
|
P:MET153
|
2.8
|
79.8
|
1.0
|
SD
|
4:MET153
|
2.9
|
79.8
|
1.0
|
SD
|
R:MET153
|
3.0
|
79.9
|
1.0
|
CE
|
Z:MET153
|
3.5
|
79.9
|
1.0
|
CE
|
P:MET153
|
3.6
|
80.0
|
1.0
|
CE
|
4:MET153
|
3.6
|
80.0
|
1.0
|
CE
|
R:MET153
|
3.6
|
80.0
|
1.0
|
CG
|
Z:MET153
|
3.7
|
79.9
|
1.0
|
CG
|
4:MET153
|
3.9
|
79.9
|
1.0
|
CG
|
P:MET153
|
4.0
|
79.9
|
1.0
|
CG
|
R:MET153
|
4.3
|
80.0
|
1.0
|
|
Reference:
O.Kasyutich,
A.Ilari,
A.Fiorillo,
D.Tatchev,
A.Hoell,
P.Ceci.
Silver Ion Incorporation and Nanoparticle Formation Inside the Cavity of Pyrococcus Furiosus Ferritin: Structural and Size-Distribution Analyses. J.Am.Chem.Soc. V. 132 3621 2010.
ISSN: ISSN 0002-7863
PubMed: 20170158
DOI: 10.1021/JA910918B
Page generated: Wed Jul 10 08:21:14 2024
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