Phosphorus in PDB 1a74: I-Ppol Homing Endonuclease/Dna Complex
Protein crystallography data
The structure of I-Ppol Homing Endonuclease/Dna Complex, PDB code: 1a74
was solved by
B.L.Jurica,
K.E.Flick,
R.J.Monnat Junior,
M.S.Stoddard,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
100.00 /
2.20
|
Space group
|
P 31 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
113.400,
113.400,
88.200,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
21.6 /
26.5
|
Phosphorus Binding Sites:
Phosphorus binding site 1 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 1 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 1 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P402
b:24.9
occ:1.00
|
P
|
C:DT402
|
0.0
|
24.9
|
1.0
|
OP2
|
C:DT402
|
1.5
|
20.2
|
1.0
|
OP1
|
C:DT402
|
1.5
|
28.2
|
1.0
|
O5'
|
C:DT402
|
1.6
|
24.5
|
1.0
|
O3'
|
C:DT401
|
1.6
|
24.1
|
1.0
|
C5'
|
C:DT402
|
2.6
|
28.4
|
1.0
|
C3'
|
C:DT401
|
2.6
|
24.3
|
1.0
|
C2'
|
C:DT401
|
3.3
|
23.0
|
1.0
|
O
|
C:HOH208
|
3.5
|
23.4
|
1.0
|
O
|
C:HOH90
|
3.8
|
20.1
|
1.0
|
O
|
C:HOH107
|
3.9
|
28.6
|
1.0
|
C4'
|
C:DT402
|
3.9
|
27.5
|
1.0
|
C4'
|
C:DT401
|
3.9
|
23.6
|
1.0
|
C1'
|
C:DT401
|
4.3
|
23.2
|
1.0
|
NH2
|
A:ARG66
|
4.3
|
13.4
|
1.0
|
C3'
|
C:DT402
|
4.5
|
27.2
|
1.0
|
CZ
|
A:ARG66
|
4.6
|
16.8
|
1.0
|
NH1
|
A:ARG66
|
4.6
|
17.6
|
1.0
|
O4'
|
C:DT401
|
4.7
|
25.0
|
1.0
|
O4'
|
C:DT402
|
5.0
|
27.9
|
1.0
|
|
Phosphorus binding site 2 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 2 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 2 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P403
b:26.1
occ:1.00
|
P
|
C:DG403
|
0.0
|
26.1
|
1.0
|
OP1
|
C:DG403
|
1.5
|
29.2
|
1.0
|
OP2
|
C:DG403
|
1.5
|
28.1
|
1.0
|
O5'
|
C:DG403
|
1.6
|
26.4
|
1.0
|
O3'
|
C:DT402
|
1.6
|
27.6
|
1.0
|
C3'
|
C:DT402
|
2.6
|
27.2
|
1.0
|
C5'
|
C:DG403
|
2.6
|
17.5
|
1.0
|
C2'
|
C:DT402
|
3.2
|
25.4
|
1.0
|
O
|
A:HOH645
|
3.7
|
28.2
|
1.0
|
N
|
A:GLY53
|
3.9
|
17.1
|
1.0
|
C4'
|
C:DG403
|
3.9
|
17.2
|
1.0
|
C4'
|
C:DT402
|
3.9
|
27.5
|
1.0
|
C1'
|
C:DT402
|
4.3
|
23.6
|
1.0
|
O4'
|
C:DG403
|
4.4
|
19.9
|
1.0
|
C3'
|
C:DG403
|
4.4
|
15.7
|
1.0
|
CA
|
A:VAL52
|
4.5
|
17.2
|
1.0
|
C2'
|
C:DG403
|
4.6
|
16.0
|
1.0
|
CA
|
A:GLY53
|
4.6
|
14.9
|
1.0
|
O4'
|
C:DT402
|
4.7
|
27.9
|
1.0
|
C8
|
C:DG403
|
4.7
|
14.5
|
1.0
|
CG1
|
A:VAL52
|
4.7
|
12.8
|
1.0
|
C
|
A:VAL52
|
4.7
|
17.7
|
1.0
|
NH2
|
A:ARG66
|
4.8
|
13.4
|
1.0
|
|
Phosphorus binding site 3 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 3 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 3 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P404
b:18.8
occ:1.00
|
P
|
C:DA404
|
0.0
|
18.8
|
1.0
|
OP2
|
C:DA404
|
1.5
|
20.1
|
1.0
|
OP1
|
C:DA404
|
1.5
|
20.9
|
1.0
|
O5'
|
C:DA404
|
1.6
|
23.1
|
1.0
|
O3'
|
C:DG403
|
1.6
|
17.5
|
1.0
|
C5'
|
C:DA404
|
2.6
|
22.4
|
1.0
|
C3'
|
C:DG403
|
2.6
|
15.7
|
1.0
|
C2'
|
C:DG403
|
3.3
|
16.0
|
1.0
|
O
|
C:HOH29
|
3.7
|
11.4
|
1.0
|
CB
|
A:ALA48
|
3.8
|
18.8
|
1.0
|
C4'
|
C:DG403
|
3.9
|
17.2
|
1.0
|
C4'
|
C:DA404
|
3.9
|
19.3
|
1.0
|
CA
|
A:PRO49
|
4.0
|
21.3
|
1.0
|
CB
|
A:PRO49
|
4.0
|
23.2
|
1.0
|
O
|
C:HOH101
|
4.1
|
14.4
|
1.0
|
C1'
|
C:DG403
|
4.2
|
15.7
|
1.0
|
C3'
|
C:DA404
|
4.4
|
20.1
|
1.0
|
O4'
|
C:DA404
|
4.5
|
19.7
|
1.0
|
N
|
A:PRO49
|
4.6
|
21.9
|
1.0
|
O4'
|
C:DG403
|
4.7
|
19.9
|
1.0
|
C2'
|
C:DA404
|
4.7
|
19.6
|
1.0
|
CA
|
A:ALA48
|
4.8
|
20.9
|
1.0
|
C
|
A:ALA48
|
4.9
|
21.5
|
1.0
|
|
Phosphorus binding site 4 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 4 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 4 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P405
b:24.1
occ:1.00
|
P
|
C:DC405
|
0.0
|
24.1
|
1.0
|
OP2
|
C:DC405
|
1.5
|
20.9
|
1.0
|
OP1
|
C:DC405
|
1.5
|
26.1
|
1.0
|
O5'
|
C:DC405
|
1.6
|
21.2
|
1.0
|
O3'
|
C:DA404
|
1.6
|
22.2
|
1.0
|
C3'
|
C:DA404
|
2.6
|
20.1
|
1.0
|
C5'
|
C:DC405
|
2.7
|
21.6
|
1.0
|
C2'
|
C:DA404
|
3.5
|
19.6
|
1.0
|
C4'
|
C:DC405
|
3.7
|
20.1
|
1.0
|
C4'
|
C:DA404
|
3.9
|
19.3
|
1.0
|
O
|
C:HOH213
|
4.0
|
33.6
|
1.0
|
O4'
|
C:DC405
|
4.0
|
18.1
|
1.0
|
O
|
C:HOH118
|
4.1
|
27.4
|
1.0
|
C1'
|
C:DA404
|
4.4
|
17.0
|
1.0
|
CB
|
A:ALA48
|
4.7
|
18.8
|
1.0
|
O4'
|
C:DA404
|
4.8
|
19.7
|
1.0
|
C5'
|
C:DA404
|
4.8
|
22.4
|
1.0
|
|
Phosphorus binding site 5 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 5 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 5 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P406
b:23.6
occ:1.00
|
P
|
C:DT406
|
0.0
|
23.6
|
1.0
|
OP1
|
C:DT406
|
1.5
|
25.5
|
1.0
|
OP2
|
C:DT406
|
1.5
|
24.9
|
1.0
|
O5'
|
C:DT406
|
1.6
|
23.0
|
1.0
|
O3'
|
C:DC405
|
1.6
|
23.2
|
1.0
|
C3'
|
C:DC405
|
2.6
|
20.2
|
1.0
|
C5'
|
C:DT406
|
2.6
|
24.9
|
1.0
|
C2'
|
C:DC405
|
3.4
|
17.3
|
1.0
|
C4'
|
C:DC405
|
3.9
|
20.1
|
1.0
|
C4'
|
C:DT406
|
3.9
|
22.2
|
1.0
|
C3'
|
C:DT406
|
4.4
|
24.8
|
1.0
|
O4'
|
C:DT406
|
4.4
|
22.9
|
1.0
|
C6
|
C:DT406
|
4.5
|
22.0
|
1.0
|
C5'
|
C:DC405
|
4.5
|
21.6
|
1.0
|
C7
|
C:DT406
|
4.6
|
13.0
|
1.0
|
C1'
|
C:DC405
|
4.8
|
18.7
|
1.0
|
O4'
|
C:DC405
|
5.0
|
18.1
|
1.0
|
|
Phosphorus binding site 6 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 6 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 6 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P407
b:28.2
occ:1.00
|
P
|
C:DC407
|
0.0
|
28.2
|
1.0
|
OP2
|
C:DC407
|
1.5
|
25.6
|
1.0
|
OP1
|
C:DC407
|
1.5
|
31.4
|
1.0
|
O5'
|
C:DC407
|
1.6
|
24.4
|
1.0
|
O3'
|
C:DT406
|
1.6
|
27.4
|
1.0
|
C3'
|
C:DT406
|
2.6
|
24.8
|
1.0
|
C5'
|
C:DC407
|
2.6
|
25.4
|
1.0
|
C2'
|
C:DT406
|
3.4
|
24.3
|
1.0
|
C4'
|
C:DT406
|
3.9
|
22.2
|
1.0
|
C4'
|
C:DC407
|
3.9
|
26.1
|
1.0
|
O4'
|
C:DC407
|
4.4
|
28.3
|
1.0
|
C3'
|
C:DC407
|
4.5
|
27.7
|
1.0
|
C5'
|
C:DT406
|
4.5
|
24.9
|
1.0
|
O
|
C:HOH168
|
4.6
|
50.6
|
1.0
|
O5'
|
C:DT406
|
4.7
|
23.0
|
1.0
|
C6
|
C:DC407
|
4.7
|
21.1
|
1.0
|
C1'
|
C:DT406
|
4.8
|
22.4
|
1.0
|
O4'
|
C:DT406
|
5.0
|
22.9
|
1.0
|
|
Phosphorus binding site 7 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 7 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 7 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P408
b:30.6
occ:1.00
|
P
|
C:DT408
|
0.0
|
30.6
|
1.0
|
OP1
|
C:DT408
|
1.5
|
32.0
|
1.0
|
OP2
|
C:DT408
|
1.5
|
29.9
|
1.0
|
O5'
|
C:DT408
|
1.6
|
26.0
|
1.0
|
O3'
|
C:DC407
|
1.6
|
31.2
|
1.0
|
C3'
|
C:DC407
|
2.6
|
27.7
|
1.0
|
C5'
|
C:DT408
|
2.6
|
23.5
|
1.0
|
C2'
|
C:DC407
|
3.3
|
26.8
|
1.0
|
C4'
|
C:DC407
|
3.9
|
26.1
|
1.0
|
C4'
|
C:DT408
|
3.9
|
23.2
|
1.0
|
O4'
|
C:DT408
|
4.4
|
26.5
|
1.0
|
C3'
|
C:DT408
|
4.5
|
24.4
|
1.0
|
C6
|
C:DT408
|
4.5
|
16.2
|
1.0
|
C5'
|
C:DC407
|
4.6
|
25.4
|
1.0
|
C1'
|
C:DC407
|
4.8
|
26.5
|
1.0
|
C2'
|
C:DT408
|
4.8
|
22.1
|
1.0
|
O5'
|
C:DC407
|
4.9
|
24.4
|
1.0
|
O4'
|
C:DC407
|
5.0
|
28.3
|
1.0
|
|
Phosphorus binding site 8 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 8 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 8 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P409
b:30.2
occ:1.00
|
P
|
C:DC409
|
0.0
|
30.2
|
1.0
|
OP1
|
C:DC409
|
1.5
|
31.0
|
1.0
|
OP2
|
C:DC409
|
1.5
|
29.8
|
1.0
|
O5'
|
C:DC409
|
1.6
|
30.8
|
1.0
|
O3'
|
C:DT408
|
1.6
|
28.6
|
1.0
|
C5'
|
C:DC409
|
2.6
|
27.0
|
1.0
|
C3'
|
C:DT408
|
2.6
|
24.4
|
1.0
|
C2'
|
C:DT408
|
3.1
|
22.1
|
1.0
|
C4'
|
C:DC409
|
3.9
|
24.4
|
1.0
|
C4'
|
C:DT408
|
3.9
|
23.2
|
1.0
|
C1'
|
C:DT408
|
4.0
|
23.1
|
1.0
|
C3'
|
C:DC409
|
4.3
|
23.7
|
1.0
|
O4'
|
C:DT408
|
4.5
|
26.5
|
1.0
|
O4'
|
C:DC409
|
4.6
|
23.0
|
1.0
|
C2'
|
C:DC409
|
4.7
|
22.0
|
1.0
|
|
Phosphorus binding site 9 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 9 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 9 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P410
b:28.0
occ:1.00
|
P
|
C:DT410
|
0.0
|
28.0
|
1.0
|
OP1
|
C:DT410
|
1.5
|
28.7
|
1.0
|
OP2
|
C:DT410
|
1.5
|
27.5
|
1.0
|
O5'
|
C:DT410
|
1.6
|
27.1
|
1.0
|
O3'
|
C:DC409
|
1.6
|
25.6
|
1.0
|
C5'
|
C:DT410
|
2.6
|
25.6
|
1.0
|
C3'
|
C:DC409
|
2.6
|
23.7
|
1.0
|
C2'
|
C:DC409
|
3.2
|
22.0
|
1.0
|
O
|
C:HOH74
|
3.3
|
19.2
|
1.0
|
C4'
|
C:DT410
|
3.9
|
23.8
|
1.0
|
C4'
|
C:DC409
|
3.9
|
24.4
|
1.0
|
C1'
|
C:DC409
|
4.1
|
18.4
|
1.0
|
C3'
|
C:DT410
|
4.2
|
23.0
|
1.0
|
O4'
|
C:DC409
|
4.6
|
23.0
|
1.0
|
O4'
|
C:DT410
|
4.7
|
24.5
|
1.0
|
C2'
|
C:DT410
|
4.7
|
20.8
|
1.0
|
|
Phosphorus binding site 10 out
of 40 in 1a74
Go back to
Phosphorus Binding Sites List in 1a74
Phosphorus binding site 10 out
of 40 in the I-Ppol Homing Endonuclease/Dna Complex
 Mono view
 Stereo pair view
|
A full contact list of Phosphorus with other atoms in the P binding
site number 10 of I-Ppol Homing Endonuclease/Dna Complex within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:P411
b:18.7
occ:1.00
|
P
|
C:DT411
|
0.0
|
18.7
|
1.0
|
OP1
|
C:DT411
|
1.5
|
22.4
|
1.0
|
OP2
|
C:DT411
|
1.5
|
23.3
|
1.0
|
O5'
|
C:DT411
|
1.6
|
21.0
|
1.0
|
O3'
|
C:DT410
|
1.6
|
21.8
|
1.0
|
C5'
|
C:DT411
|
2.6
|
24.0
|
1.0
|
C3'
|
C:DT410
|
2.6
|
23.0
|
1.0
|
C2'
|
C:DT410
|
3.4
|
20.8
|
1.0
|
C4'
|
C:DT411
|
3.8
|
18.3
|
1.0
|
C4'
|
C:DT410
|
3.9
|
23.8
|
1.0
|
C1'
|
C:DT410
|
4.4
|
20.1
|
1.0
|
C3'
|
C:DT411
|
4.5
|
19.5
|
1.0
|
O4'
|
C:DT410
|
4.8
|
24.5
|
1.0
|
O4'
|
C:DT411
|
4.9
|
19.9
|
1.0
|
C5'
|
C:DT410
|
5.0
|
25.6
|
1.0
|
|
Reference:
K.E.Flick,
M.S.Jurica,
R.J.Monnat Jr.,
B.L.Stoddard.
Dna Binding and Cleavage By the Nuclear Intron-Encoded Homing Endonuclease I-Ppoi. Nature V. 394 96 1998.
ISSN: ISSN 0028-0836
PubMed: 9665136
DOI: 10.1038/27952
Page generated: Fri Sep 25 12:22:14 2020
|