Sodium in PDB 4fzy: Exonuclease X in Complex with 12BP Blunt-Ended Dsdna
Protein crystallography data
The structure of Exonuclease X in Complex with 12BP Blunt-Ended Dsdna, PDB code: 4fzy
was solved by
T.Wang,
H.Sun,
F.Cheng,
L.Bi,
T.Jiang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
20.00 /
2.50
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
37.282,
78.887,
146.668,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
21.9 /
24.1
|
Sodium Binding Sites:
The binding sites of Sodium atom in the Exonuclease X in Complex with 12BP Blunt-Ended Dsdna
(pdb code 4fzy). This binding sites where shown within
5.0 Angstroms radius around Sodium atom.
In total 4 binding sites of Sodium where determined in the
Exonuclease X in Complex with 12BP Blunt-Ended Dsdna, PDB code: 4fzy:
Jump to Sodium binding site number:
1;
2;
3;
4;
Sodium binding site 1 out
of 4 in 4fzy
Go back to
Sodium Binding Sites List in 4fzy
Sodium binding site 1 out
of 4 in the Exonuclease X in Complex with 12BP Blunt-Ended Dsdna
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 1 of Exonuclease X in Complex with 12BP Blunt-Ended Dsdna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Na101
b:31.0
occ:1.00
|
OD1
|
A:ASP6
|
2.2
|
14.4
|
1.0
|
O
|
C:HOH202
|
2.2
|
23.3
|
1.0
|
O
|
A:HOH303
|
2.2
|
25.4
|
1.0
|
O
|
A:HOH304
|
2.4
|
16.1
|
1.0
|
OP1
|
C:DG12
|
2.4
|
20.1
|
1.0
|
O3'
|
C:DA11
|
2.8
|
11.2
|
1.0
|
P
|
C:DG12
|
3.2
|
17.0
|
1.0
|
CG
|
A:ASP6
|
3.4
|
15.7
|
1.0
|
NA
|
A:NA201
|
3.7
|
22.3
|
1.0
|
OD2
|
A:ASP85
|
3.7
|
21.7
|
1.0
|
OD1
|
A:ASP85
|
4.0
|
21.0
|
1.0
|
O
|
A:THR7
|
4.0
|
15.9
|
1.0
|
OD2
|
A:ASP6
|
4.0
|
18.1
|
1.0
|
C3'
|
C:DA11
|
4.0
|
11.7
|
1.0
|
O5'
|
C:DG12
|
4.1
|
14.9
|
1.0
|
C5'
|
C:DG12
|
4.1
|
11.6
|
1.0
|
CG
|
A:ASP85
|
4.3
|
19.3
|
1.0
|
N
|
A:THR7
|
4.3
|
13.3
|
1.0
|
C4'
|
C:DA11
|
4.4
|
9.6
|
1.0
|
OP2
|
C:DG12
|
4.4
|
14.7
|
1.0
|
O
|
A:HIS80
|
4.6
|
12.1
|
1.0
|
CB
|
A:ASP6
|
4.6
|
13.1
|
1.0
|
CA
|
A:ASP6
|
4.8
|
14.8
|
1.0
|
C2'
|
C:DA11
|
4.8
|
10.7
|
1.0
|
CG2
|
A:THR7
|
4.8
|
16.4
|
1.0
|
C
|
A:THR7
|
4.9
|
14.5
|
1.0
|
|
Sodium binding site 2 out
of 4 in 4fzy
Go back to
Sodium Binding Sites List in 4fzy
Sodium binding site 2 out
of 4 in the Exonuclease X in Complex with 12BP Blunt-Ended Dsdna
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 2 of Exonuclease X in Complex with 12BP Blunt-Ended Dsdna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na201
b:22.3
occ:1.00
|
OD2
|
A:ASP139
|
2.1
|
18.2
|
1.0
|
OP1
|
C:DG12
|
2.2
|
20.1
|
1.0
|
OD2
|
A:ASP6
|
2.6
|
18.1
|
1.0
|
OE2
|
A:GLU8
|
2.6
|
13.9
|
1.0
|
CG
|
A:ASP139
|
3.1
|
17.1
|
1.0
|
CG
|
A:ASP6
|
3.4
|
15.7
|
1.0
|
OD1
|
A:ASP6
|
3.4
|
14.4
|
1.0
|
CD
|
A:GLU8
|
3.4
|
17.1
|
1.0
|
OE1
|
A:GLU8
|
3.5
|
12.8
|
1.0
|
P
|
C:DG12
|
3.6
|
17.0
|
1.0
|
CB
|
A:ASP139
|
3.6
|
11.5
|
1.0
|
NA
|
C:NA101
|
3.7
|
31.0
|
1.0
|
O
|
C:HOH202
|
3.9
|
23.3
|
1.0
|
CA
|
A:HIS134
|
4.0
|
15.0
|
1.0
|
CD2
|
A:HIS134
|
4.0
|
13.0
|
1.0
|
OD1
|
A:ASP139
|
4.2
|
17.0
|
1.0
|
O5'
|
C:DG12
|
4.2
|
14.9
|
1.0
|
OP2
|
C:DG12
|
4.2
|
14.7
|
1.0
|
N
|
A:ALA136
|
4.4
|
17.1
|
1.0
|
O
|
A:THR7
|
4.4
|
15.9
|
1.0
|
O
|
A:HOH302
|
4.4
|
31.6
|
1.0
|
C
|
A:HIS134
|
4.5
|
15.8
|
1.0
|
CG
|
A:HIS134
|
4.6
|
14.9
|
1.0
|
O3'
|
C:DA11
|
4.7
|
11.2
|
1.0
|
CB
|
A:HIS134
|
4.7
|
14.9
|
1.0
|
CA
|
A:ALA136
|
4.7
|
14.7
|
1.0
|
N
|
A:HIS134
|
4.8
|
14.9
|
1.0
|
N
|
A:ARG135
|
4.8
|
18.4
|
1.0
|
CB
|
A:ASP6
|
4.9
|
13.1
|
1.0
|
NE2
|
A:HIS134
|
4.9
|
21.1
|
1.0
|
CG
|
A:GLU8
|
4.9
|
12.1
|
1.0
|
C5'
|
C:DG12
|
4.9
|
11.6
|
1.0
|
O
|
A:HIS134
|
4.9
|
13.7
|
1.0
|
|
Sodium binding site 3 out
of 4 in 4fzy
Go back to
Sodium Binding Sites List in 4fzy
Sodium binding site 3 out
of 4 in the Exonuclease X in Complex with 12BP Blunt-Ended Dsdna
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 3 of Exonuclease X in Complex with 12BP Blunt-Ended Dsdna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Na101
b:27.0
occ:1.00
|
O
|
D:HOH202
|
2.1
|
24.9
|
1.0
|
OD1
|
B:ASP6
|
2.2
|
20.7
|
1.0
|
O
|
B:HOH306
|
2.2
|
25.2
|
1.0
|
O
|
B:HOH307
|
2.3
|
19.1
|
1.0
|
OP1
|
D:DA12
|
2.6
|
12.4
|
1.0
|
O3'
|
D:DC11
|
2.8
|
16.7
|
1.0
|
P
|
D:DA12
|
3.3
|
11.9
|
1.0
|
CG
|
B:ASP6
|
3.4
|
19.8
|
1.0
|
NA
|
B:NA201
|
3.7
|
24.7
|
1.0
|
OD2
|
B:ASP6
|
3.9
|
20.0
|
1.0
|
OD2
|
B:ASP85
|
3.9
|
29.0
|
1.0
|
C5'
|
D:DA12
|
3.9
|
16.9
|
1.0
|
O
|
B:THR7
|
4.0
|
17.3
|
1.0
|
C3'
|
D:DC11
|
4.0
|
12.1
|
1.0
|
O
|
B:HOH301
|
4.1
|
25.2
|
1.0
|
O5'
|
D:DA12
|
4.1
|
12.9
|
1.0
|
OD1
|
B:ASP85
|
4.2
|
21.6
|
1.0
|
C4'
|
D:DC11
|
4.3
|
15.5
|
1.0
|
N
|
B:THR7
|
4.4
|
14.3
|
1.0
|
OP2
|
D:DA12
|
4.5
|
13.2
|
1.0
|
CG
|
B:ASP85
|
4.5
|
24.0
|
1.0
|
CB
|
B:ASP6
|
4.6
|
14.9
|
1.0
|
C2'
|
D:DC11
|
4.7
|
17.3
|
1.0
|
O
|
B:HIS80
|
4.7
|
20.0
|
1.0
|
CA
|
B:ASP6
|
4.9
|
15.4
|
1.0
|
C5'
|
D:DC11
|
4.9
|
13.8
|
1.0
|
CD2
|
B:PHE84
|
4.9
|
20.7
|
1.0
|
C
|
B:THR7
|
5.0
|
15.4
|
1.0
|
|
Sodium binding site 4 out
of 4 in 4fzy
Go back to
Sodium Binding Sites List in 4fzy
Sodium binding site 4 out
of 4 in the Exonuclease X in Complex with 12BP Blunt-Ended Dsdna
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 4 of Exonuclease X in Complex with 12BP Blunt-Ended Dsdna within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na201
b:24.7
occ:1.00
|
OP1
|
D:DA12
|
2.3
|
12.4
|
1.0
|
OD2
|
B:ASP139
|
2.3
|
32.9
|
1.0
|
OE2
|
B:GLU8
|
2.7
|
17.0
|
1.0
|
OD2
|
B:ASP6
|
2.8
|
20.0
|
1.0
|
CG
|
B:ASP139
|
3.3
|
28.6
|
1.0
|
CD
|
B:GLU8
|
3.4
|
14.9
|
1.0
|
OE1
|
B:GLU8
|
3.4
|
13.4
|
1.0
|
CG
|
B:ASP6
|
3.6
|
19.8
|
1.0
|
CB
|
B:ASP139
|
3.6
|
20.4
|
1.0
|
OD1
|
B:ASP6
|
3.6
|
20.7
|
1.0
|
P
|
D:DA12
|
3.7
|
11.9
|
1.0
|
ND1
|
B:HIS134
|
3.7
|
57.6
|
1.0
|
NA
|
D:NA101
|
3.7
|
27.0
|
1.0
|
O
|
D:HOH202
|
4.0
|
24.9
|
1.0
|
CA
|
B:HIS134
|
4.1
|
50.3
|
1.0
|
O5'
|
D:DA12
|
4.3
|
12.9
|
1.0
|
OP2
|
D:DA12
|
4.4
|
13.2
|
1.0
|
C
|
B:HIS134
|
4.4
|
45.9
|
1.0
|
OD1
|
B:ASP139
|
4.5
|
29.6
|
1.0
|
CE1
|
B:HIS134
|
4.5
|
58.8
|
1.0
|
O
|
B:ARG135
|
4.6
|
33.6
|
1.0
|
O
|
B:THR7
|
4.6
|
17.3
|
1.0
|
O
|
B:HOH301
|
4.7
|
25.2
|
1.0
|
CG
|
B:HIS134
|
4.7
|
57.1
|
1.0
|
O3'
|
D:DC11
|
4.7
|
16.7
|
1.0
|
O
|
B:HIS134
|
4.7
|
44.4
|
1.0
|
C5'
|
D:DA12
|
4.8
|
16.9
|
1.0
|
CG
|
B:GLU8
|
4.8
|
13.0
|
1.0
|
C
|
B:ARG135
|
4.8
|
33.6
|
1.0
|
CB
|
B:HIS134
|
4.9
|
51.9
|
1.0
|
N
|
B:ARG135
|
4.9
|
40.9
|
1.0
|
N
|
B:HIS134
|
4.9
|
53.6
|
1.0
|
|
Reference:
T.Wang,
H.L.Sun,
F.Cheng,
X.E.Zhang,
L.Bi,
T.Jiang.
Recognition and Processing of Double-Stranded Dna By Exox, A Distributive 3'-5' Exonuclease Nucleic Acids Res. V. 41 7556 2013.
ISSN: ISSN 0305-1048
PubMed: 23771145
DOI: 10.1093/NAR/GKT495
Page generated: Mon Oct 7 15:29:54 2024
|