Phosphorus in PDB 1a0a: Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Protein crystallography data
The structure of Phosphate System Positive Regulatory Protein PHO4/Dna Complex, PDB code: 1a0a
was solved by
T.Shimizu,
A.Toumoto,
K.Ihara,
M.Shimizu,
Y.Kyogoku,
N.Ogawa,
Y.Oshima,
T.Hakoshima,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
8.00 /
2.80
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
53.510,
68.300,
108.770,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
23 /
28.4
|
Phosphorus Binding Sites:
Phosphorus binding site 1 out
of 32 in 1a0a
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Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 1 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 1 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P2
b:36.2
occ:1.00
|
P
|
C:DT2
|
0.0
|
36.2
|
1.0
|
OP2
|
C:DT2
|
1.5
|
34.0
|
1.0
|
OP1
|
C:DT2
|
1.5
|
33.1
|
1.0
|
O5'
|
C:DT2
|
1.6
|
40.7
|
1.0
|
O3'
|
C:DC1
|
1.6
|
38.8
|
1.0
|
C3'
|
C:DC1
|
2.6
|
38.7
|
1.0
|
C5'
|
C:DT2
|
2.7
|
37.5
|
1.0
|
C2'
|
C:DC1
|
3.2
|
37.3
|
1.0
|
C4'
|
C:DT2
|
3.4
|
33.8
|
1.0
|
C2'
|
C:DT2
|
3.5
|
36.4
|
1.0
|
C3'
|
C:DT2
|
3.6
|
37.9
|
1.0
|
O4'
|
C:DT2
|
3.7
|
21.9
|
1.0
|
C4'
|
C:DC1
|
4.0
|
35.4
|
1.0
|
C6
|
C:DT2
|
4.1
|
42.5
|
1.0
|
C1'
|
C:DT2
|
4.1
|
34.5
|
1.0
|
C1'
|
C:DC1
|
4.3
|
32.1
|
1.0
|
N1
|
C:DT2
|
4.5
|
36.9
|
1.0
|
NZ
|
A:LYS1
|
4.6
|
5.9
|
1.0
|
O4'
|
C:DC1
|
4.6
|
39.1
|
1.0
|
O3'
|
C:DT2
|
5.0
|
31.1
|
1.0
|
|
Phosphorus binding site 2 out
of 32 in 1a0a
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Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 2 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 2 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P3
b:29.5
occ:1.00
|
P
|
C:DC3
|
0.0
|
29.5
|
1.0
|
OP1
|
C:DC3
|
1.5
|
24.6
|
1.0
|
OP2
|
C:DC3
|
1.5
|
29.0
|
1.0
|
O5'
|
C:DC3
|
1.6
|
19.6
|
1.0
|
O3'
|
C:DT2
|
1.6
|
31.1
|
1.0
|
C5'
|
C:DC3
|
2.6
|
24.8
|
1.0
|
C3'
|
C:DT2
|
2.7
|
37.9
|
1.0
|
C2'
|
C:DT2
|
2.9
|
36.4
|
1.0
|
C1'
|
C:DT2
|
3.6
|
34.5
|
1.0
|
C4'
|
C:DC3
|
3.6
|
32.2
|
1.0
|
C3'
|
C:DC3
|
3.7
|
36.8
|
1.0
|
C4'
|
C:DT2
|
3.9
|
33.8
|
1.0
|
O4'
|
C:DT2
|
4.4
|
21.9
|
1.0
|
C2'
|
C:DC3
|
4.4
|
37.2
|
1.0
|
O
|
C:HOH34
|
4.5
|
31.6
|
1.0
|
C6
|
C:DC3
|
4.7
|
31.3
|
1.0
|
O4'
|
C:DC3
|
4.7
|
30.4
|
1.0
|
O3'
|
C:DC3
|
4.8
|
35.0
|
1.0
|
N1
|
C:DT2
|
4.8
|
36.9
|
1.0
|
|
Phosphorus binding site 3 out
of 32 in 1a0a
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Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 3 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 3 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P4
b:34.7
occ:1.00
|
P
|
C:DA4
|
0.0
|
34.7
|
1.0
|
OP1
|
C:DA4
|
1.5
|
22.3
|
1.0
|
OP2
|
C:DA4
|
1.5
|
30.0
|
1.0
|
O5'
|
C:DA4
|
1.6
|
28.5
|
1.0
|
O3'
|
C:DC3
|
1.6
|
35.0
|
1.0
|
C5'
|
C:DA4
|
2.6
|
26.3
|
1.0
|
C3'
|
C:DC3
|
2.7
|
36.8
|
1.0
|
C2'
|
C:DC3
|
3.0
|
37.2
|
1.0
|
C4'
|
C:DA4
|
3.5
|
29.2
|
1.0
|
C2'
|
C:DA4
|
3.6
|
28.8
|
1.0
|
CD
|
A:ARG12
|
3.6
|
33.9
|
1.0
|
C3'
|
C:DA4
|
3.7
|
36.5
|
1.0
|
NE
|
A:ARG12
|
3.7
|
29.4
|
1.0
|
O4'
|
C:DA4
|
3.7
|
27.6
|
1.0
|
O
|
B:ALA38
|
3.9
|
42.0
|
1.0
|
C4'
|
C:DC3
|
4.0
|
32.2
|
1.0
|
C1'
|
C:DC3
|
4.1
|
36.4
|
1.0
|
C1'
|
C:DA4
|
4.2
|
28.1
|
1.0
|
C8
|
C:DA4
|
4.3
|
28.9
|
1.0
|
CG
|
A:ARG12
|
4.3
|
38.2
|
1.0
|
CB
|
B:ALA39
|
4.4
|
45.2
|
1.0
|
O4'
|
C:DC3
|
4.6
|
30.4
|
1.0
|
N9
|
C:DA4
|
4.7
|
31.6
|
1.0
|
C
|
B:ALA38
|
4.7
|
45.6
|
1.0
|
CB
|
B:ALA38
|
4.8
|
46.0
|
1.0
|
CZ
|
A:ARG12
|
5.0
|
31.5
|
1.0
|
|
Phosphorus binding site 4 out
of 32 in 1a0a
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Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 4 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 4 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P5
b:54.8
occ:1.00
|
P
|
C:DC5
|
0.0
|
54.8
|
1.0
|
OP1
|
C:DC5
|
1.5
|
49.9
|
1.0
|
OP2
|
C:DC5
|
1.5
|
54.6
|
1.0
|
O5'
|
C:DC5
|
1.6
|
54.2
|
1.0
|
O3'
|
C:DA4
|
1.6
|
50.2
|
1.0
|
C5'
|
C:DC5
|
2.6
|
52.1
|
1.0
|
C3'
|
C:DA4
|
2.7
|
36.5
|
1.0
|
C2'
|
C:DA4
|
2.9
|
28.8
|
1.0
|
OG
|
B:SER41
|
3.5
|
31.5
|
1.0
|
C1'
|
C:DA4
|
3.5
|
28.1
|
1.0
|
C3'
|
C:DC5
|
3.5
|
42.8
|
1.0
|
C4'
|
C:DC5
|
3.6
|
47.1
|
1.0
|
C2'
|
C:DC5
|
3.7
|
46.1
|
1.0
|
CB
|
B:SER41
|
3.9
|
39.9
|
1.0
|
C4'
|
C:DA4
|
3.9
|
29.2
|
1.0
|
NH2
|
A:ARG12
|
4.3
|
28.7
|
1.0
|
O4'
|
C:DA4
|
4.3
|
27.6
|
1.0
|
O4'
|
C:DC5
|
4.4
|
48.2
|
1.0
|
C6
|
C:DC5
|
4.6
|
48.1
|
1.0
|
C1'
|
C:DC5
|
4.6
|
47.2
|
1.0
|
N9
|
C:DA4
|
4.7
|
31.6
|
1.0
|
O3'
|
C:DC5
|
4.9
|
32.3
|
1.0
|
|
Phosphorus binding site 5 out
of 32 in 1a0a
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Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 5 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 5 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P6
b:30.6
occ:1.00
|
P
|
C:DA6
|
0.0
|
30.6
|
1.0
|
OP1
|
C:DA6
|
1.5
|
27.8
|
1.0
|
OP2
|
C:DA6
|
1.5
|
23.5
|
1.0
|
O5'
|
C:DA6
|
1.6
|
17.4
|
1.0
|
O3'
|
C:DC5
|
1.6
|
32.3
|
1.0
|
C3'
|
C:DC5
|
2.6
|
42.8
|
1.0
|
C5'
|
C:DA6
|
2.6
|
14.7
|
1.0
|
C2'
|
C:DC5
|
3.4
|
46.1
|
1.0
|
C4'
|
C:DA6
|
3.7
|
13.7
|
1.0
|
O4'
|
C:DA6
|
3.7
|
2.0
|
1.0
|
C8
|
C:DA6
|
3.8
|
25.6
|
1.0
|
C4'
|
C:DC5
|
3.9
|
47.1
|
1.0
|
O
|
C:HOH32
|
4.1
|
51.1
|
1.0
|
C1'
|
C:DC5
|
4.3
|
47.2
|
1.0
|
N9
|
C:DA6
|
4.5
|
21.5
|
1.0
|
C3'
|
C:DA6
|
4.5
|
7.1
|
1.0
|
C2'
|
C:DA6
|
4.5
|
3.2
|
1.0
|
C1'
|
C:DA6
|
4.5
|
10.4
|
1.0
|
OP1
|
C:DC5
|
4.5
|
49.9
|
1.0
|
O4'
|
C:DC5
|
4.6
|
48.2
|
1.0
|
N7
|
C:DA6
|
4.7
|
32.8
|
1.0
|
NZ
|
B:LYS42
|
5.0
|
26.6
|
1.0
|
C5'
|
C:DC5
|
5.0
|
52.1
|
1.0
|
|
Phosphorus binding site 6 out
of 32 in 1a0a
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Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 6 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 6 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P7
b:27.2
occ:1.00
|
P
|
C:DC7
|
0.0
|
27.2
|
1.0
|
OP2
|
C:DC7
|
1.5
|
32.2
|
1.0
|
OP1
|
C:DC7
|
1.5
|
18.6
|
1.0
|
O5'
|
C:DC7
|
1.6
|
20.0
|
1.0
|
O3'
|
C:DA6
|
1.6
|
18.1
|
1.0
|
C5'
|
C:DC7
|
2.6
|
27.8
|
1.0
|
C3'
|
C:DA6
|
2.6
|
7.1
|
1.0
|
C2'
|
C:DA6
|
3.1
|
3.2
|
1.0
|
C4'
|
C:DC7
|
3.9
|
23.9
|
1.0
|
C6
|
C:DC7
|
3.9
|
39.4
|
1.0
|
C4'
|
C:DA6
|
4.0
|
13.7
|
1.0
|
C1'
|
C:DA6
|
4.1
|
10.4
|
1.0
|
O4'
|
C:DC7
|
4.3
|
24.5
|
1.0
|
C3'
|
C:DC7
|
4.4
|
22.2
|
1.0
|
C5
|
C:DC7
|
4.5
|
45.3
|
1.0
|
C2'
|
C:DC7
|
4.6
|
24.4
|
1.0
|
O4'
|
C:DA6
|
4.6
|
2.0
|
1.0
|
CG
|
B:GLN10
|
4.7
|
22.7
|
1.0
|
N1
|
C:DC7
|
4.9
|
34.7
|
1.0
|
C1'
|
C:DC7
|
4.9
|
28.6
|
1.0
|
|
Phosphorus binding site 7 out
of 32 in 1a0a
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Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 7 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 7 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P8
b:27.9
occ:1.00
|
P
|
C:DG8
|
0.0
|
27.9
|
1.0
|
OP2
|
C:DG8
|
1.5
|
22.4
|
1.0
|
OP1
|
C:DG8
|
1.5
|
24.5
|
1.0
|
O5'
|
C:DG8
|
1.6
|
19.9
|
1.0
|
O3'
|
C:DC7
|
1.6
|
26.1
|
1.0
|
C3'
|
C:DC7
|
2.6
|
22.2
|
1.0
|
C5'
|
C:DG8
|
2.7
|
20.6
|
1.0
|
C2'
|
C:DC7
|
3.0
|
24.4
|
1.0
|
O
|
C:HOH35
|
3.2
|
2.1
|
1.0
|
C8
|
C:DG8
|
3.6
|
30.7
|
1.0
|
CE
|
B:LYS6
|
3.7
|
2.0
|
1.0
|
C4'
|
C:DG8
|
3.7
|
12.3
|
1.0
|
C2'
|
C:DG8
|
3.7
|
9.4
|
1.0
|
C3'
|
C:DG8
|
3.8
|
11.6
|
1.0
|
C4'
|
C:DC7
|
3.9
|
23.9
|
1.0
|
C1'
|
C:DC7
|
3.9
|
28.6
|
1.0
|
NZ
|
B:LYS6
|
4.3
|
2.0
|
1.0
|
O4'
|
C:DG8
|
4.4
|
10.5
|
1.0
|
N9
|
C:DG8
|
4.4
|
26.9
|
1.0
|
C1'
|
C:DG8
|
4.4
|
20.9
|
1.0
|
O4'
|
C:DC7
|
4.5
|
24.5
|
1.0
|
N7
|
C:DG8
|
4.5
|
31.9
|
1.0
|
CB
|
B:LYS6
|
4.9
|
18.8
|
1.0
|
CD
|
B:LYS6
|
5.0
|
12.9
|
1.0
|
|
Phosphorus binding site 8 out
of 32 in 1a0a
Go back to
Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 8 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 8 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P9
b:2.4
occ:1.00
|
P
|
C:DT9
|
0.0
|
2.4
|
1.0
|
OP2
|
C:DT9
|
1.5
|
6.9
|
1.0
|
OP1
|
C:DT9
|
1.5
|
2.1
|
1.0
|
O5'
|
C:DT9
|
1.6
|
12.7
|
1.0
|
O3'
|
C:DG8
|
1.6
|
14.8
|
1.0
|
C5'
|
C:DT9
|
2.6
|
4.9
|
1.0
|
C3'
|
C:DG8
|
2.7
|
11.6
|
1.0
|
C2'
|
C:DG8
|
2.9
|
9.4
|
1.0
|
C3'
|
C:DT9
|
3.1
|
23.2
|
1.0
|
C2'
|
C:DT9
|
3.2
|
19.8
|
1.0
|
C1'
|
C:DG8
|
3.2
|
20.9
|
1.0
|
C4'
|
C:DT9
|
3.5
|
21.1
|
1.0
|
C4'
|
C:DG8
|
3.6
|
12.3
|
1.0
|
O4'
|
C:DG8
|
3.7
|
10.5
|
1.0
|
C6
|
C:DT9
|
3.8
|
33.6
|
1.0
|
NZ
|
B:LYS6
|
3.9
|
2.0
|
1.0
|
O4'
|
C:DT9
|
4.1
|
18.8
|
1.0
|
C1'
|
C:DT9
|
4.1
|
26.1
|
1.0
|
O3'
|
C:DT9
|
4.4
|
22.4
|
1.0
|
CE
|
B:LYS6
|
4.4
|
2.0
|
1.0
|
N1
|
C:DT9
|
4.5
|
34.3
|
1.0
|
N9
|
C:DG8
|
4.6
|
26.9
|
1.0
|
CD
|
B:LYS6
|
4.6
|
12.9
|
1.0
|
C5
|
C:DT9
|
4.7
|
34.0
|
1.0
|
OP1
|
C:DG10
|
4.7
|
25.0
|
1.0
|
C7
|
C:DT9
|
4.7
|
28.8
|
1.0
|
OP2
|
C:DG10
|
4.8
|
22.2
|
1.0
|
P
|
C:DG10
|
4.9
|
27.3
|
1.0
|
|
Phosphorus binding site 9 out
of 32 in 1a0a
Go back to
Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 9 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 9 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P10
b:27.3
occ:1.00
|
P
|
C:DG10
|
0.0
|
27.3
|
1.0
|
OP1
|
C:DG10
|
1.5
|
25.0
|
1.0
|
OP2
|
C:DG10
|
1.5
|
22.2
|
1.0
|
O5'
|
C:DG10
|
1.6
|
29.2
|
1.0
|
O3'
|
C:DT9
|
1.6
|
22.4
|
1.0
|
C3'
|
C:DT9
|
2.6
|
23.2
|
1.0
|
C5'
|
C:DG10
|
2.6
|
36.0
|
1.0
|
C2'
|
C:DT9
|
3.2
|
19.8
|
1.0
|
C4'
|
C:DG10
|
3.5
|
40.3
|
1.0
|
O4'
|
C:DG10
|
3.5
|
28.5
|
1.0
|
OP1
|
C:DT9
|
3.9
|
2.1
|
1.0
|
C4'
|
C:DT9
|
3.9
|
21.1
|
1.0
|
C3'
|
C:DG10
|
4.2
|
40.9
|
1.0
|
C8
|
C:DG10
|
4.2
|
40.2
|
1.0
|
C2'
|
C:DG10
|
4.3
|
35.2
|
1.0
|
C1'
|
C:DT9
|
4.3
|
26.1
|
1.0
|
C1'
|
C:DG10
|
4.4
|
37.1
|
1.0
|
N9
|
C:DG10
|
4.7
|
37.3
|
1.0
|
O4'
|
C:DT9
|
4.7
|
18.8
|
1.0
|
C5'
|
C:DT9
|
4.9
|
4.9
|
1.0
|
P
|
C:DT9
|
4.9
|
2.4
|
1.0
|
|
Phosphorus binding site 10 out
of 32 in 1a0a
Go back to
Phosphorus Binding Sites List in 1a0a
Phosphorus binding site 10 out
of 32 in the Phosphate System Positive Regulatory Protein PHO4/Dna Complex
Mono view
Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 10 of Phosphate System Positive Regulatory Protein PHO4/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P11
b:45.8
occ:1.00
|
P
|
C:DG11
|
0.0
|
45.8
|
1.0
|
OP2
|
C:DG11
|
1.5
|
44.6
|
1.0
|
OP1
|
C:DG11
|
1.5
|
35.7
|
1.0
|
O5'
|
C:DG11
|
1.6
|
51.1
|
1.0
|
O3'
|
C:DG10
|
1.6
|
42.7
|
1.0
|
C5'
|
C:DG11
|
2.6
|
52.6
|
1.0
|
C3'
|
C:DG10
|
2.7
|
40.9
|
1.0
|
C2'
|
C:DG10
|
3.1
|
35.2
|
1.0
|
C4'
|
C:DG11
|
3.8
|
55.5
|
1.0
|
C3'
|
C:DG11
|
3.8
|
56.0
|
1.0
|
C1'
|
C:DG10
|
3.9
|
37.1
|
1.0
|
C4'
|
C:DG10
|
4.0
|
40.3
|
1.0
|
C2'
|
C:DG11
|
4.4
|
59.8
|
1.0
|
OP2
|
C:DG12
|
4.5
|
43.1
|
1.0
|
O4'
|
C:DG10
|
4.6
|
28.5
|
1.0
|
O4'
|
C:DG11
|
4.8
|
57.6
|
1.0
|
|
Reference:
T.Shimizu,
A.Toumoto,
K.Ihara,
M.Shimizu,
Y.Kyogoku,
N.Ogawa,
Y.Oshima,
T.Hakoshima.
Crystal Structure of PHO4 Bhlh Domain-Dna Complex: Flanking Base Recognition. Embo J. V. 16 4689 1997.
ISSN: ISSN 0261-4189
PubMed: 9303313
DOI: 10.1093/EMBOJ/16.15.4689
Page generated: Fri Sep 25 11:56:02 2020
|