Phosphorus in PDB 113d: The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Protein crystallography data
The structure of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution, PDB code: 113d
was solved by
W.N.Hunter,
T.Brown,
G.Kneale,
N.N.Anand,
D.Rabinovich,
O.Kennard,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
8.00 /
2.50
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
25.530,
41.220,
65.630,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
n/a /
n/a
|
Phosphorus Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
20;
Page 3, Binding sites: 21 -
22;
Binding sites:
The binding sites of Phosphorus atom in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
(pdb code 113d). This binding sites where shown within
5.0 Angstroms radius around Phosphorus atom.
In total 22 binding sites of Phosphorus where determined in the
The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution, PDB code: 113d:
Jump to Phosphorus binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Phosphorus binding site 1 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 1 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 1 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P2
b:41.0
occ:1.00
|
P
|
A:DG2
|
0.0
|
41.0
|
1.0
|
OP1
|
A:DG2
|
1.5
|
41.0
|
1.0
|
OP2
|
A:DG2
|
1.5
|
41.0
|
1.0
|
O3'
|
A:DC1
|
1.6
|
36.0
|
1.0
|
O5'
|
A:DG2
|
1.6
|
31.0
|
1.0
|
C5'
|
A:DG2
|
2.6
|
31.0
|
1.0
|
C3'
|
A:DC1
|
2.7
|
36.0
|
1.0
|
C2'
|
A:DC1
|
3.3
|
36.0
|
1.0
|
O
|
A:HOH74
|
3.9
|
66.0
|
1.0
|
C4'
|
A:DC1
|
3.9
|
36.0
|
1.0
|
C4'
|
A:DG2
|
4.0
|
31.0
|
1.0
|
O
|
A:HOH56
|
4.0
|
53.0
|
1.0
|
O
|
A:HOH94
|
4.2
|
72.0
|
1.0
|
C1'
|
A:DC1
|
4.4
|
36.0
|
1.0
|
C3'
|
A:DG2
|
4.4
|
31.0
|
1.0
|
C2'
|
A:DG2
|
4.6
|
31.0
|
1.0
|
O4'
|
A:DG2
|
4.7
|
31.0
|
1.0
|
O5'
|
A:DC1
|
4.7
|
36.0
|
1.0
|
O4'
|
A:DC1
|
4.7
|
36.0
|
1.0
|
C5'
|
A:DC1
|
5.0
|
36.0
|
1.0
|
|
Phosphorus binding site 2 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 2 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 2 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P3
b:38.0
occ:1.00
|
P
|
A:DC3
|
0.0
|
38.0
|
1.0
|
OP1
|
A:DC3
|
1.5
|
38.0
|
1.0
|
OP2
|
A:DC3
|
1.5
|
38.0
|
1.0
|
O5'
|
A:DC3
|
1.6
|
24.0
|
1.0
|
O3'
|
A:DG2
|
1.6
|
31.0
|
1.0
|
C3'
|
A:DG2
|
2.6
|
31.0
|
1.0
|
C5'
|
A:DC3
|
2.7
|
24.0
|
1.0
|
C2'
|
A:DG2
|
3.3
|
31.0
|
1.0
|
C4'
|
A:DC3
|
3.8
|
24.0
|
1.0
|
O
|
A:HOH55
|
3.9
|
51.0
|
1.0
|
O4'
|
A:DC3
|
3.9
|
24.0
|
1.0
|
C4'
|
A:DG2
|
4.0
|
31.0
|
1.0
|
C1'
|
A:DG2
|
4.3
|
31.0
|
1.0
|
C3'
|
A:DC3
|
4.5
|
24.0
|
1.0
|
O4'
|
A:DG2
|
4.7
|
31.0
|
1.0
|
C6
|
A:DC3
|
4.9
|
20.0
|
1.0
|
O
|
A:HOH94
|
5.0
|
72.0
|
1.0
|
|
Phosphorus binding site 3 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 3 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 3 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P4
b:38.0
occ:1.00
|
P
|
A:DG4
|
0.0
|
38.0
|
1.0
|
OP2
|
A:DG4
|
1.5
|
38.0
|
1.0
|
OP1
|
A:DG4
|
1.5
|
38.0
|
1.0
|
O5'
|
A:DG4
|
1.6
|
30.0
|
1.0
|
O3'
|
A:DC3
|
1.6
|
24.0
|
1.0
|
C3'
|
A:DC3
|
2.6
|
24.0
|
1.0
|
C5'
|
A:DG4
|
2.7
|
30.0
|
1.0
|
C2'
|
A:DC3
|
3.4
|
24.0
|
1.0
|
O4'
|
A:DG4
|
3.7
|
30.0
|
1.0
|
C4'
|
A:DG4
|
3.7
|
30.0
|
1.0
|
C4'
|
A:DC3
|
3.9
|
24.0
|
1.0
|
O
|
A:HOH93
|
4.1
|
68.0
|
1.0
|
C3'
|
A:DG4
|
4.4
|
30.0
|
1.0
|
C5'
|
A:DC3
|
4.4
|
24.0
|
1.0
|
O
|
A:HOH39
|
4.5
|
49.0
|
1.0
|
O
|
A:HOH41
|
4.5
|
54.0
|
1.0
|
C2'
|
A:DG4
|
4.6
|
30.0
|
1.0
|
C8
|
A:DG4
|
4.7
|
17.0
|
1.0
|
C1'
|
A:DG4
|
4.7
|
30.0
|
1.0
|
C1'
|
A:DC3
|
4.8
|
24.0
|
1.0
|
O5'
|
A:DC3
|
4.8
|
24.0
|
1.0
|
O4'
|
A:DC3
|
4.9
|
24.0
|
1.0
|
|
Phosphorus binding site 4 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 4 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 4 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P5
b:44.0
occ:1.00
|
P
|
A:DA5
|
0.0
|
44.0
|
1.0
|
OP2
|
A:DA5
|
1.5
|
44.0
|
1.0
|
OP1
|
A:DA5
|
1.5
|
44.0
|
1.0
|
O5'
|
A:DA5
|
1.6
|
35.0
|
1.0
|
O3'
|
A:DG4
|
1.6
|
30.0
|
1.0
|
C3'
|
A:DG4
|
2.7
|
30.0
|
1.0
|
C5'
|
A:DA5
|
2.7
|
35.0
|
1.0
|
C2'
|
A:DG4
|
3.4
|
30.0
|
1.0
|
C4'
|
A:DA5
|
3.9
|
35.0
|
1.0
|
C4'
|
A:DG4
|
4.0
|
30.0
|
1.0
|
O
|
A:HOH50
|
4.1
|
63.0
|
1.0
|
O
|
A:HOH76
|
4.2
|
64.0
|
1.0
|
C1'
|
A:DG4
|
4.3
|
30.0
|
1.0
|
C3'
|
A:DA5
|
4.4
|
35.0
|
1.0
|
O4'
|
A:DA5
|
4.6
|
35.0
|
1.0
|
C2'
|
A:DA5
|
4.7
|
35.0
|
1.0
|
C8
|
A:DA5
|
4.7
|
19.0
|
1.0
|
O4'
|
A:DG4
|
4.9
|
30.0
|
1.0
|
C5'
|
A:DG4
|
4.9
|
30.0
|
1.0
|
|
Phosphorus binding site 5 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 5 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 5 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P6
b:42.0
occ:1.00
|
P
|
A:DA6
|
0.0
|
42.0
|
1.0
|
OP1
|
A:DA6
|
1.5
|
42.0
|
1.0
|
OP2
|
A:DA6
|
1.5
|
42.0
|
1.0
|
O3'
|
A:DA5
|
1.6
|
35.0
|
1.0
|
O5'
|
A:DA6
|
1.6
|
30.0
|
1.0
|
C5'
|
A:DA6
|
2.6
|
30.0
|
1.0
|
C3'
|
A:DA5
|
2.6
|
35.0
|
1.0
|
C2'
|
A:DA5
|
3.2
|
35.0
|
1.0
|
C4'
|
A:DA6
|
3.8
|
30.0
|
1.0
|
C4'
|
A:DA5
|
4.0
|
35.0
|
1.0
|
C1'
|
A:DA5
|
4.1
|
35.0
|
1.0
|
C3'
|
A:DA6
|
4.2
|
30.0
|
1.0
|
C2'
|
A:DA6
|
4.4
|
30.0
|
1.0
|
O
|
A:HOH54
|
4.5
|
60.0
|
1.0
|
O4'
|
A:DA5
|
4.6
|
35.0
|
1.0
|
O
|
A:HOH61
|
4.6
|
66.0
|
1.0
|
O4'
|
A:DA6
|
4.6
|
30.0
|
1.0
|
C8
|
A:DA6
|
4.8
|
12.0
|
1.0
|
O
|
A:HOH70
|
4.9
|
59.0
|
1.0
|
|
Phosphorus binding site 6 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 6 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 6 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P7
b:36.0
occ:1.00
|
P
|
A:DT7
|
0.0
|
36.0
|
1.0
|
OP1
|
A:DT7
|
1.5
|
36.0
|
1.0
|
OP2
|
A:DT7
|
1.5
|
36.0
|
1.0
|
O3'
|
A:DA6
|
1.6
|
30.0
|
1.0
|
O5'
|
A:DT7
|
1.6
|
30.0
|
1.0
|
C5'
|
A:DT7
|
2.6
|
30.0
|
1.0
|
C3'
|
A:DA6
|
2.7
|
30.0
|
1.0
|
C2'
|
A:DA6
|
3.3
|
30.0
|
1.0
|
O
|
A:HOH65
|
3.8
|
47.0
|
1.0
|
C4'
|
A:DT7
|
3.9
|
30.0
|
1.0
|
C4'
|
A:DA6
|
3.9
|
30.0
|
1.0
|
O
|
A:HOH61
|
4.0
|
66.0
|
1.0
|
C1'
|
A:DA6
|
4.1
|
30.0
|
1.0
|
C3'
|
A:DT7
|
4.4
|
30.0
|
1.0
|
O4'
|
A:DA6
|
4.5
|
30.0
|
1.0
|
O4'
|
A:DT7
|
4.5
|
30.0
|
1.0
|
|
Phosphorus binding site 7 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 7 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 7 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P8
b:34.0
occ:1.00
|
P
|
A:DT8
|
0.0
|
34.0
|
1.0
|
OP2
|
A:DT8
|
1.5
|
34.0
|
1.0
|
OP1
|
A:DT8
|
1.5
|
34.0
|
1.0
|
O3'
|
A:DT7
|
1.6
|
30.0
|
1.0
|
O5'
|
A:DT8
|
1.6
|
33.0
|
1.0
|
C5'
|
A:DT8
|
2.7
|
33.0
|
1.0
|
C3'
|
A:DT7
|
2.7
|
30.0
|
1.0
|
C2'
|
A:DT7
|
3.2
|
30.0
|
1.0
|
O
|
A:HOH86
|
3.7
|
58.0
|
1.0
|
C4'
|
A:DT8
|
3.9
|
33.0
|
1.0
|
C4'
|
A:DT7
|
3.9
|
30.0
|
1.0
|
O
|
A:HOH89
|
4.2
|
66.0
|
1.0
|
O4'
|
A:DT8
|
4.2
|
33.0
|
1.0
|
C1'
|
A:DT7
|
4.3
|
30.0
|
1.0
|
C3'
|
A:DT8
|
4.6
|
33.0
|
1.0
|
O4'
|
A:DT7
|
4.7
|
30.0
|
1.0
|
|
Phosphorus binding site 8 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 8 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 8 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P9
b:41.0
occ:1.00
|
P
|
A:DT9
|
0.0
|
41.0
|
1.0
|
OP1
|
A:DT9
|
1.5
|
41.0
|
1.0
|
OP2
|
A:DT9
|
1.5
|
41.0
|
1.0
|
O5'
|
A:DT9
|
1.6
|
35.0
|
1.0
|
O3'
|
A:DT8
|
1.6
|
33.0
|
1.0
|
C5'
|
A:DT9
|
2.6
|
35.0
|
1.0
|
C3'
|
A:DT8
|
2.7
|
33.0
|
1.0
|
C2'
|
A:DT8
|
3.4
|
33.0
|
1.0
|
O
|
A:HOH85
|
3.7
|
74.0
|
1.0
|
O
|
A:HOH82
|
3.8
|
65.0
|
1.0
|
O
|
A:HOH42
|
3.8
|
40.0
|
1.0
|
C4'
|
A:DT9
|
3.9
|
35.0
|
1.0
|
C4'
|
A:DT8
|
4.0
|
33.0
|
1.0
|
O
|
A:HOH69
|
4.1
|
66.0
|
1.0
|
O4'
|
A:DT9
|
4.2
|
35.0
|
1.0
|
C1'
|
A:DT8
|
4.4
|
33.0
|
1.0
|
C3'
|
A:DT9
|
4.5
|
35.0
|
1.0
|
O4'
|
A:DT8
|
4.8
|
33.0
|
1.0
|
C5'
|
A:DT8
|
4.9
|
33.0
|
1.0
|
|
Phosphorus binding site 9 out
of 22 in 113d
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Phosphorus Binding Sites List in 113d
Phosphorus binding site 9 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 9 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P10
b:44.0
occ:1.00
|
P
|
A:DG10
|
0.0
|
44.0
|
1.0
|
OP2
|
A:DG10
|
1.5
|
44.0
|
1.0
|
OP1
|
A:DG10
|
1.5
|
44.0
|
1.0
|
O3'
|
A:DT9
|
1.6
|
35.0
|
1.0
|
O5'
|
A:DG10
|
1.6
|
35.0
|
1.0
|
C3'
|
A:DT9
|
2.7
|
35.0
|
1.0
|
C5'
|
A:DG10
|
2.7
|
35.0
|
1.0
|
C2'
|
A:DT9
|
3.5
|
35.0
|
1.0
|
O
|
A:HOH82
|
3.7
|
65.0
|
1.0
|
C4'
|
A:DT9
|
3.9
|
35.0
|
1.0
|
C4'
|
A:DG10
|
4.0
|
35.0
|
1.0
|
C2'
|
A:DG10
|
4.4
|
35.0
|
1.0
|
O4'
|
A:DG10
|
4.4
|
35.0
|
1.0
|
C5'
|
A:DT9
|
4.5
|
35.0
|
1.0
|
C3'
|
A:DG10
|
4.5
|
35.0
|
1.0
|
C8
|
A:DG10
|
4.8
|
21.0
|
1.0
|
O
|
A:HOH85
|
4.8
|
74.0
|
1.0
|
C1'
|
A:DG10
|
4.8
|
35.0
|
1.0
|
O5'
|
A:DT9
|
4.8
|
35.0
|
1.0
|
C1'
|
A:DT9
|
4.9
|
35.0
|
1.0
|
O4'
|
A:DT9
|
5.0
|
35.0
|
1.0
|
|
Phosphorus binding site 10 out
of 22 in 113d
Go back to
Phosphorus Binding Sites List in 113d
Phosphorus binding site 10 out
of 22 in the The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 10 of The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5 Angstroms Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:P11
b:50.0
occ:1.00
|
P
|
A:DC11
|
0.0
|
50.0
|
1.0
|
OP1
|
A:DC11
|
1.5
|
50.0
|
1.0
|
OP2
|
A:DC11
|
1.5
|
50.0
|
1.0
|
O5'
|
A:DC11
|
1.6
|
42.0
|
1.0
|
O3'
|
A:DG10
|
1.6
|
35.0
|
1.0
|
C5'
|
A:DC11
|
2.6
|
42.0
|
1.0
|
C3'
|
A:DG10
|
2.7
|
35.0
|
1.0
|
O
|
A:HOH31
|
3.3
|
65.0
|
1.0
|
C4'
|
A:DG10
|
3.4
|
35.0
|
1.0
|
C6
|
A:DC11
|
3.9
|
28.0
|
1.0
|
C4'
|
A:DC11
|
3.9
|
42.0
|
1.0
|
C2'
|
A:DG10
|
3.9
|
35.0
|
1.0
|
O4'
|
A:DG10
|
4.3
|
35.0
|
1.0
|
C1'
|
A:DG10
|
4.4
|
35.0
|
1.0
|
O4'
|
A:DC11
|
4.4
|
42.0
|
1.0
|
C3'
|
A:DC11
|
4.5
|
42.0
|
1.0
|
C2'
|
A:DC11
|
4.5
|
42.0
|
1.0
|
C5
|
A:DC11
|
4.6
|
28.0
|
1.0
|
C5'
|
A:DG10
|
4.6
|
35.0
|
1.0
|
N1
|
A:DC11
|
4.8
|
28.0
|
1.0
|
C1'
|
A:DC11
|
4.8
|
42.0
|
1.0
|
|
Reference:
W.N.Hunter,
T.Brown,
G.Kneale,
N.N.Anand,
D.Rabinovich,
O.Kennard.
The Structure of Guanosine-Thymidine Mismatches in B-Dna at 2.5-A Resolution. J.Biol.Chem. V. 262 9962 1987.
ISSN: ISSN 0021-9258
PubMed: 3611072
Page generated: Fri Sep 25 11:09:07 2020
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