Gold in PDB 4acl: 3D Structure of Dotu From Francisella Novicida
Protein crystallography data
The structure of 3D Structure of Dotu From Francisella Novicida, PDB code: 4acl
was solved by
C.S.Robb,
F.E.Nano,
A.B.Boraston,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
65.43 /
2.49
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
39.309,
85.314,
66.989,
90.00,
102.38,
90.00
|
R / Rfree (%)
|
21.8 /
27.9
|
Other elements in 4acl:
The structure of 3D Structure of Dotu From Francisella Novicida also contains other interesting chemical elements:
Gold Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
12;
Binding sites:
The binding sites of Gold atom in the 3D Structure of Dotu From Francisella Novicida
(pdb code 4acl). This binding sites where shown within
5.0 Angstroms radius around Gold atom.
In total 12 binding sites of Gold where determined in the
3D Structure of Dotu From Francisella Novicida, PDB code: 4acl:
Jump to Gold binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Gold binding site 1 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 1 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 1 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Au1159
b:59.8
occ:1.00
|
CB
|
A:CYS57
|
3.2
|
28.2
|
1.0
|
CG
|
A:LEU49
|
3.4
|
42.2
|
1.0
|
CD2
|
A:LEU49
|
3.5
|
36.1
|
1.0
|
CD1
|
A:LEU49
|
3.6
|
44.5
|
1.0
|
NE2
|
A:GLN45
|
3.7
|
37.4
|
1.0
|
CD
|
A:GLN45
|
3.9
|
36.5
|
1.0
|
CB
|
A:GLN45
|
3.9
|
38.8
|
1.0
|
CG
|
A:GLN45
|
4.0
|
39.3
|
1.0
|
OE1
|
A:GLN45
|
4.5
|
34.8
|
1.0
|
CA
|
A:GLN45
|
4.6
|
39.6
|
1.0
|
CA
|
A:CYS57
|
4.7
|
29.6
|
1.0
|
OE1
|
A:GLU54
|
4.7
|
49.4
|
1.0
|
O
|
A:GLN45
|
4.7
|
42.2
|
1.0
|
CB
|
A:LEU49
|
4.8
|
40.8
|
1.0
|
C
|
A:GLN45
|
5.0
|
41.2
|
1.0
|
|
Gold binding site 2 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 2 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 2 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Au1160
b:58.2
occ:0.50
|
ND1
|
A:HIS154
|
2.6
|
59.3
|
1.0
|
O
|
A:HOH2022
|
3.1
|
38.2
|
1.0
|
CE2
|
A:TYR120
|
3.4
|
35.8
|
1.0
|
CG
|
A:HIS154
|
3.5
|
59.5
|
1.0
|
CE1
|
A:HIS154
|
3.5
|
56.9
|
1.0
|
CD2
|
A:TYR120
|
3.7
|
35.3
|
1.0
|
CB
|
A:HIS154
|
3.7
|
61.0
|
1.0
|
CZ
|
A:TYR120
|
3.7
|
37.1
|
1.0
|
CG2
|
A:ILE114
|
4.0
|
51.4
|
1.0
|
O
|
A:HIS154
|
4.1
|
64.1
|
1.0
|
OH
|
A:TYR120
|
4.2
|
36.2
|
1.0
|
CG
|
A:TYR120
|
4.3
|
35.4
|
1.0
|
CE1
|
A:TYR120
|
4.3
|
34.8
|
1.0
|
CA
|
A:HIS154
|
4.4
|
61.7
|
1.0
|
OE1
|
A:GLN117
|
4.4
|
59.4
|
1.0
|
CD1
|
A:TYR120
|
4.5
|
33.8
|
1.0
|
NE2
|
A:HIS154
|
4.6
|
57.3
|
1.0
|
CD2
|
A:HIS154
|
4.6
|
59.5
|
1.0
|
O
|
A:TYR115
|
4.7
|
42.5
|
1.0
|
C
|
A:HIS154
|
4.7
|
63.0
|
1.0
|
CD1
|
A:ILE114
|
4.8
|
54.4
|
1.0
|
|
Gold binding site 3 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 3 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 3 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Au1161
b:97.1
occ:0.40
|
NE2
|
A:HIS154
|
2.9
|
57.3
|
1.0
|
CE1
|
A:HIS154
|
3.1
|
56.9
|
1.0
|
O
|
A:LEU110
|
3.2
|
49.4
|
1.0
|
C
|
A:LEU110
|
4.2
|
49.0
|
1.0
|
CD2
|
A:HIS154
|
4.3
|
59.5
|
1.0
|
ND1
|
A:HIS154
|
4.4
|
59.3
|
1.0
|
CA
|
A:LEU110
|
4.4
|
47.4
|
1.0
|
CD1
|
A:ILE114
|
4.4
|
54.4
|
1.0
|
CB
|
A:LEU110
|
4.9
|
46.5
|
1.0
|
OE1
|
A:GLU150
|
4.9
|
59.4
|
1.0
|
CD2
|
A:LEU110
|
5.0
|
42.9
|
1.0
|
CG
|
A:HIS154
|
5.0
|
59.5
|
1.0
|
|
Gold binding site 4 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 4 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 4 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Au1162
b:72.4
occ:0.20
|
CB
|
A:HIS128
|
3.2
|
36.0
|
1.0
|
O
|
A:HOH2028
|
3.3
|
42.6
|
1.0
|
CA
|
A:HIS128
|
3.5
|
36.5
|
1.0
|
O
|
A:HIS128
|
3.6
|
37.9
|
1.0
|
AU
|
A:AU1166
|
4.0
|
59.2
|
0.3
|
C
|
A:HIS128
|
4.1
|
37.0
|
1.0
|
N
|
A:HIS128
|
4.8
|
36.7
|
1.0
|
|
Gold binding site 5 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 5 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 5 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Au1164
b:57.1
occ:0.50
|
ND1
|
A:HIS142
|
4.0
|
41.4
|
0.5
|
CE1
|
A:HIS142
|
4.5
|
42.0
|
0.5
|
|
Gold binding site 6 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 6 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 6 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Au1166
b:59.2
occ:0.30
|
OD2
|
A:ASP152
|
3.0
|
55.7
|
1.0
|
AU
|
A:AU1162
|
4.0
|
72.4
|
0.2
|
CG
|
A:ASP152
|
4.2
|
54.9
|
1.0
|
O
|
A:HOH2027
|
4.6
|
46.8
|
1.0
|
OD1
|
A:ASP152
|
4.7
|
53.0
|
1.0
|
O
|
A:HOH2028
|
5.0
|
42.6
|
1.0
|
|
Gold binding site 7 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 7 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 7 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Au1157
b:83.7
occ:0.70
|
ND1
|
B:HIS154
|
2.8
|
68.8
|
1.0
|
CE2
|
B:TYR120
|
3.5
|
40.8
|
1.0
|
CG
|
B:HIS154
|
3.5
|
68.5
|
1.0
|
CB
|
B:HIS154
|
3.6
|
68.4
|
1.0
|
O
|
B:HOH2009
|
3.7
|
60.9
|
1.0
|
CD2
|
B:TYR120
|
3.7
|
40.7
|
1.0
|
CE1
|
B:HIS154
|
3.8
|
67.8
|
1.0
|
O
|
B:HIS154
|
3.9
|
69.8
|
1.0
|
CZ
|
B:TYR120
|
3.9
|
45.0
|
1.0
|
OE1
|
B:GLN117
|
4.1
|
52.7
|
1.0
|
CA
|
B:HIS154
|
4.2
|
68.7
|
1.0
|
CG
|
B:TYR120
|
4.3
|
41.2
|
1.0
|
OH
|
B:TYR120
|
4.4
|
44.9
|
1.0
|
CE1
|
B:TYR120
|
4.4
|
46.7
|
1.0
|
C
|
B:HIS154
|
4.5
|
69.8
|
1.0
|
CD1
|
B:TYR120
|
4.6
|
44.4
|
1.0
|
CD2
|
B:HIS154
|
4.7
|
69.0
|
1.0
|
O
|
B:TYR115
|
4.7
|
46.9
|
1.0
|
NE2
|
B:HIS154
|
4.8
|
68.7
|
1.0
|
|
Gold binding site 8 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 8 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 8 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Au1158
b:55.8
occ:0.30
|
OD2
|
B:ASP152
|
2.7
|
66.4
|
1.0
|
CG
|
B:ASP152
|
3.6
|
64.4
|
1.0
|
OD1
|
B:ASP152
|
4.0
|
62.9
|
1.0
|
OG
|
B:SER124
|
4.6
|
39.7
|
1.0
|
CB
|
B:ASP152
|
4.8
|
63.3
|
1.0
|
|
Gold binding site 9 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 9 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 9 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Au1159
b:66.6
occ:0.30
|
ND1
|
B:HIS142
|
2.2
|
39.3
|
1.0
|
CG
|
B:HIS142
|
3.0
|
37.8
|
1.0
|
CB
|
B:HIS142
|
3.2
|
36.1
|
1.0
|
CE1
|
B:HIS142
|
3.3
|
36.1
|
1.0
|
CD2
|
B:HIS142
|
4.2
|
35.8
|
1.0
|
NE2
|
B:HIS142
|
4.3
|
35.5
|
1.0
|
CA
|
B:HIS142
|
4.7
|
36.2
|
1.0
|
|
Gold binding site 10 out
of 12 in 4acl
Go back to
Gold Binding Sites List in 4acl
Gold binding site 10 out
of 12 in the 3D Structure of Dotu From Francisella Novicida
Mono view
Stereo pair view
|
A full contact list of Gold with other atoms in the Au binding
site number 10 of 3D Structure of Dotu From Francisella Novicida within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Au1160
b:78.9
occ:1.00
|
CB
|
B:CYS57
|
2.8
|
36.7
|
1.0
|
O
|
B:HOH2004
|
3.2
|
56.7
|
1.0
|
CD1
|
B:LEU49
|
3.3
|
45.8
|
1.0
|
NE2
|
B:GLN45
|
3.4
|
51.9
|
1.0
|
CG
|
B:GLN45
|
3.7
|
50.8
|
1.0
|
CD2
|
B:LEU49
|
3.8
|
42.1
|
1.0
|
CG
|
B:LEU49
|
3.9
|
45.1
|
1.0
|
CD
|
B:GLN45
|
3.9
|
51.1
|
1.0
|
OH
|
B:TYR93
|
4.0
|
64.2
|
1.0
|
CA
|
B:CYS57
|
4.2
|
36.7
|
1.0
|
CB
|
B:GLN45
|
4.3
|
50.8
|
1.0
|
OE1
|
B:GLU54
|
4.3
|
43.2
|
0.1
|
C
|
B:CYS57
|
4.6
|
36.2
|
1.0
|
O
|
B:GLU54
|
4.7
|
40.9
|
1.0
|
N
|
B:LYS58
|
4.8
|
35.6
|
1.0
|
CD
|
B:GLU54
|
4.9
|
44.0
|
1.0
|
CA
|
B:GLN45
|
4.9
|
51.1
|
1.0
|
|
Reference:
C.S.Robb,
F.E.Nano,
A.B.Boraston.
The Structure of the Conserved Type Six Secretion Protein Tssl (Dotu) From Francisella Novicida J.Mol.Biol. V. 419 277 2012.
ISSN: ISSN 0022-2836
PubMed: 22504227
DOI: 10.1016/J.JMB.2012.04.003
Page generated: Wed Jul 10 14:23:11 2024
|