Uranium in PDB 1b58: Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
Protein crystallography data
The structure of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk, PDB code: 1b58
was solved by
J.R.H.Tame,
A.J.Wilkinson,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
15.00 /
1.80
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
110.670,
76.620,
71.650,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
17.9 /
22.3
|
Uranium Binding Sites:
The binding sites of Uranium atom in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
(pdb code 1b58). This binding sites where shown within
5.0 Angstroms radius around Uranium atom.
In total 8 binding sites of Uranium where determined in the
Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk, PDB code: 1b58:
Jump to Uranium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Uranium binding site 1 out
of 8 in 1b58
Go back to
Uranium Binding Sites List in 1b58
Uranium binding site 1 out
of 8 in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
 Mono view
 Stereo pair view
|
A full contact list of Uranium with other atoms in the U binding
site number 1 of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:U518
b:17.9
occ:1.00
|
O
|
A:HOH530
|
2.3
|
15.9
|
1.0
|
OD2
|
A:ASP323
|
2.5
|
10.0
|
1.0
|
O
|
A:HOH651
|
2.8
|
18.6
|
1.0
|
CG
|
A:ASP323
|
3.3
|
14.2
|
1.0
|
OD1
|
A:ASP323
|
3.3
|
14.5
|
1.0
|
O
|
A:HOH527
|
4.3
|
15.7
|
1.0
|
CB
|
A:ASP323
|
4.7
|
5.7
|
1.0
|
NZ
|
A:LYS157
|
4.9
|
18.1
|
1.0
|
|
Uranium binding site 2 out
of 8 in 1b58
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Uranium Binding Sites List in 1b58
Uranium binding site 2 out
of 8 in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
 Mono view
 Stereo pair view
|
A full contact list of Uranium with other atoms in the U binding
site number 2 of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:U519
b:25.8
occ:1.00
|
O
|
A:HOH613
|
2.7
|
16.9
|
1.0
|
O
|
A:HOH545
|
2.7
|
20.0
|
1.0
|
O
|
A:HOH536
|
2.9
|
7.8
|
1.0
|
O
|
A:HOH615
|
2.9
|
18.8
|
1.0
|
U
|
A:IUM520
|
4.2
|
28.1
|
1.0
|
O
|
A:HOH658
|
4.2
|
27.9
|
1.0
|
O
|
A:HOH623
|
4.4
|
24.6
|
1.0
|
O
|
A:HOH568
|
4.9
|
22.9
|
1.0
|
O
|
A:HOH712
|
4.9
|
24.8
|
1.0
|
|
Uranium binding site 3 out
of 8 in 1b58
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Uranium Binding Sites List in 1b58
Uranium binding site 3 out
of 8 in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
 Mono view
 Stereo pair view
|
A full contact list of Uranium with other atoms in the U binding
site number 3 of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:U520
b:28.1
occ:1.00
|
O
|
A:HOH712
|
2.7
|
24.8
|
1.0
|
O
|
A:HOH645
|
3.1
|
17.3
|
1.0
|
O
|
A:HOH605
|
3.2
|
29.6
|
1.0
|
O
|
A:HOH693
|
3.4
|
26.5
|
1.0
|
OD1
|
A:ASP459
|
4.0
|
45.2
|
1.0
|
U
|
A:IUM519
|
4.2
|
25.8
|
1.0
|
OD2
|
A:ASP459
|
4.4
|
50.4
|
1.0
|
CG
|
A:ASP459
|
4.5
|
44.8
|
1.0
|
O
|
A:HOH613
|
4.7
|
16.9
|
1.0
|
O
|
A:HOH623
|
4.9
|
24.6
|
1.0
|
CB
|
A:PRO153
|
4.9
|
19.4
|
1.0
|
|
Uranium binding site 4 out
of 8 in 1b58
Go back to
Uranium Binding Sites List in 1b58
Uranium binding site 4 out
of 8 in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
 Mono view
 Stereo pair view
|
A full contact list of Uranium with other atoms in the U binding
site number 4 of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:U521
b:54.0
occ:1.00
|
OE2
|
A:GLU251
|
2.8
|
52.6
|
1.0
|
O
|
A:HOH841
|
3.3
|
56.1
|
1.0
|
OD1
|
A:ASP369
|
3.6
|
35.9
|
1.0
|
CD
|
A:GLU251
|
4.0
|
60.2
|
1.0
|
CG
|
A:ASP369
|
4.4
|
30.9
|
1.0
|
CG
|
A:GLU251
|
4.5
|
59.3
|
1.0
|
CE
|
A:LYS373
|
4.6
|
42.1
|
1.0
|
CB
|
A:ASP369
|
4.9
|
22.5
|
1.0
|
OE1
|
A:GLU251
|
4.9
|
60.8
|
1.0
|
|
Uranium binding site 5 out
of 8 in 1b58
Go back to
Uranium Binding Sites List in 1b58
Uranium binding site 5 out
of 8 in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
 Mono view
 Stereo pair view
|
A full contact list of Uranium with other atoms in the U binding
site number 5 of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:U522
b:23.6
occ:1.00
|
OD2
|
A:ASP362
|
2.5
|
12.0
|
1.0
|
OD2
|
A:ASP410
|
2.6
|
15.0
|
1.0
|
O
|
A:HOH644
|
2.8
|
23.4
|
1.0
|
CG
|
A:ASP362
|
3.3
|
13.7
|
1.0
|
OD1
|
A:ASP410
|
3.4
|
7.9
|
1.0
|
CG
|
A:ASP410
|
3.4
|
12.8
|
1.0
|
OD1
|
A:ASP362
|
3.8
|
15.5
|
1.0
|
NZ
|
A:LYS281
|
4.1
|
29.6
|
1.0
|
N
|
A:ASP362
|
4.2
|
14.8
|
1.0
|
CB
|
A:ASP362
|
4.3
|
13.6
|
1.0
|
O
|
A:HOH650
|
4.6
|
36.1
|
1.0
|
CA
|
A:PHE361
|
4.7
|
21.0
|
1.0
|
CB
|
A:ASP410
|
4.8
|
11.4
|
1.0
|
C
|
A:PHE361
|
4.8
|
20.7
|
1.0
|
CA
|
A:ASP362
|
5.0
|
15.9
|
1.0
|
|
Uranium binding site 6 out
of 8 in 1b58
Go back to
Uranium Binding Sites List in 1b58
Uranium binding site 6 out
of 8 in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
 Mono view
 Stereo pair view
|
A full contact list of Uranium with other atoms in the U binding
site number 6 of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:U523
b:34.7
occ:1.00
|
O
|
A:HIS517
|
2.7
|
26.0
|
1.0
|
OXT
|
A:HIS517
|
2.8
|
15.5
|
1.0
|
C
|
A:HIS517
|
3.0
|
24.7
|
1.0
|
U
|
A:IUM524
|
4.2
|
40.0
|
1.0
|
O
|
A:HOH777
|
4.5
|
44.5
|
1.0
|
CA
|
A:HIS517
|
4.6
|
24.5
|
1.0
|
O
|
A:HOH839
|
4.8
|
26.1
|
1.0
|
CD2
|
A:HIS517
|
4.9
|
20.1
|
1.0
|
O
|
A:HOH583
|
4.9
|
26.1
|
1.0
|
|
Uranium binding site 7 out
of 8 in 1b58
Go back to
Uranium Binding Sites List in 1b58
Uranium binding site 7 out
of 8 in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
 Mono view
 Stereo pair view
|
A full contact list of Uranium with other atoms in the U binding
site number 7 of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:U524
b:40.0
occ:1.00
|
O
|
A:HOH661
|
2.9
|
19.5
|
1.0
|
O
|
A:HOH696
|
2.9
|
41.9
|
1.0
|
O
|
A:HOH839
|
2.9
|
26.1
|
1.0
|
O
|
A:HOH731
|
3.0
|
27.6
|
1.0
|
U
|
A:IUM523
|
4.2
|
34.7
|
1.0
|
|
Uranium binding site 8 out
of 8 in 1b58
Go back to
Uranium Binding Sites List in 1b58
Uranium binding site 8 out
of 8 in the Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk
 Mono view
 Stereo pair view
|
A full contact list of Uranium with other atoms in the U binding
site number 8 of Oligo-Peptide Binding Protein (Oppa) Complexed with Kyk within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:U525
b:43.6
occ:1.00
|
OD2
|
A:ASP11
|
2.5
|
27.3
|
1.0
|
O
|
A:HOH752
|
3.0
|
48.4
|
1.0
|
O
|
A:HOH630
|
3.1
|
28.1
|
1.0
|
O
|
A:HOH662
|
3.2
|
38.5
|
1.0
|
CG
|
A:ASP11
|
3.5
|
27.5
|
1.0
|
CB
|
A:ASP11
|
3.6
|
23.9
|
1.0
|
OD1
|
A:ASP11
|
4.6
|
34.3
|
1.0
|
|
Reference:
S.H.Sleigh,
P.R.Seavers,
A.J.Wilkinson,
J.E.Ladbury,
J.R.Tame.
Crystallographic and Calorimetric Analysis of Peptide Binding to Oppa Protein. J.Mol.Biol. V. 291 393 1999.
ISSN: ISSN 0022-2836
PubMed: 10438628
DOI: 10.1006/JMBI.1999.2929
Page generated: Fri Oct 11 10:41:32 2024
|