Sodium in PDB 7vuk: Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Protein crystallography data
The structure of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp., PDB code: 7vuk
was solved by
K.Fukui,
T.Yano,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
49.37 /
3.38
|
Space group
|
P 41 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
133.654,
133.654,
197.461,
90,
90,
90
|
R / Rfree (%)
|
26.7 /
27.2
|
Other elements in 7vuk:
The structure of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. also contains other interesting chemical elements:
Sodium Binding Sites:
The binding sites of Sodium atom in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
(pdb code 7vuk). This binding sites where shown within
5.0 Angstroms radius around Sodium atom.
In total 8 binding sites of Sodium where determined in the
Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp., PDB code: 7vuk:
Jump to Sodium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Sodium binding site 1 out
of 8 in 7vuk
Go back to
Sodium Binding Sites List in 7vuk
Sodium binding site 1 out
of 8 in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 1 of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na504
b:38.4
occ:1.00
|
O
|
A:ALA51
|
3.5
|
65.3
|
1.0
|
CB
|
A:ALA267
|
4.0
|
64.0
|
1.0
|
CB
|
A:PRO55
|
4.0
|
76.7
|
1.0
|
O
|
A:GLN264
|
4.2
|
61.8
|
1.0
|
CA
|
A:PRO55
|
4.5
|
75.8
|
1.0
|
CG
|
A:PRO55
|
4.5
|
80.8
|
1.0
|
CG
|
A:GLN264
|
4.6
|
63.0
|
1.0
|
C
|
A:ALA51
|
4.6
|
66.0
|
1.0
|
N
|
A:ALA268
|
4.7
|
59.4
|
1.0
|
CD2
|
A:LEU52
|
4.8
|
54.4
|
1.0
|
C
|
A:ALA267
|
4.9
|
62.5
|
1.0
|
CA
|
A:LEU52
|
5.0
|
57.0
|
1.0
|
CA
|
A:GLN264
|
5.0
|
62.1
|
1.0
|
|
Sodium binding site 2 out
of 8 in 7vuk
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Sodium Binding Sites List in 7vuk
Sodium binding site 2 out
of 8 in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 2 of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na505
b:37.2
occ:1.00
|
OD1
|
A:ASP272
|
3.7
|
64.4
|
1.0
|
OD2
|
A:ASP272
|
4.0
|
70.8
|
1.0
|
CB
|
A:ALA268
|
4.0
|
61.6
|
1.0
|
CG
|
A:ASP272
|
4.2
|
67.9
|
1.0
|
CA
|
A:ALA268
|
4.7
|
58.2
|
1.0
|
O
|
A:ALA268
|
5.0
|
55.8
|
1.0
|
|
Sodium binding site 3 out
of 8 in 7vuk
Go back to
Sodium Binding Sites List in 7vuk
Sodium binding site 3 out
of 8 in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 3 of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na506
b:26.1
occ:1.00
|
OE1
|
A:GLN410
|
3.5
|
76.9
|
1.0
|
CB
|
A:ALA406
|
4.2
|
46.3
|
1.0
|
N
|
A:ALA407
|
4.3
|
58.2
|
1.0
|
CA
|
A:ALA407
|
4.3
|
58.7
|
1.0
|
CB
|
A:PRO431
|
4.4
|
40.6
|
1.0
|
CB
|
A:ALA407
|
4.5
|
65.5
|
1.0
|
CD
|
A:GLN410
|
4.6
|
72.3
|
1.0
|
C
|
A:ALA406
|
4.7
|
49.9
|
1.0
|
|
Sodium binding site 4 out
of 8 in 7vuk
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Sodium Binding Sites List in 7vuk
Sodium binding site 4 out
of 8 in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 4 of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na507
b:31.3
occ:1.00
|
ND1
|
A:HIS428
|
3.9
|
55.9
|
1.0
|
NZ
|
A:LYS433
|
4.2
|
47.1
|
1.0
|
OH
|
A:TYR469
|
4.2
|
70.4
|
1.0
|
C
|
A:GLY315
|
4.3
|
67.5
|
1.0
|
O
|
A:GLY315
|
4.3
|
72.0
|
1.0
|
CE1
|
A:HIS428
|
4.6
|
61.0
|
1.0
|
CA
|
A:GLY315
|
4.6
|
62.9
|
1.0
|
N
|
A:PRO316
|
4.6
|
70.9
|
1.0
|
N
|
A:GLY315
|
4.6
|
58.8
|
1.0
|
CA
|
A:PRO316
|
4.7
|
71.0
|
1.0
|
|
Sodium binding site 5 out
of 8 in 7vuk
Go back to
Sodium Binding Sites List in 7vuk
Sodium binding site 5 out
of 8 in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 5 of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na508
b:32.3
occ:1.00
|
NZ
|
A:LYS326
|
3.4
|
64.2
|
1.0
|
OE1
|
A:GLU9
|
3.5
|
70.6
|
1.0
|
NE2
|
A:HIS291
|
3.9
|
62.0
|
1.0
|
CG1
|
A:ILE294
|
4.1
|
48.4
|
1.0
|
CE1
|
A:HIS291
|
4.2
|
63.8
|
1.0
|
CD1
|
A:ILE294
|
4.3
|
48.5
|
1.0
|
CD2
|
A:HIS291
|
4.3
|
59.1
|
1.0
|
CD
|
A:GLU9
|
4.4
|
66.3
|
1.0
|
OE2
|
A:GLU9
|
4.5
|
63.2
|
1.0
|
CB
|
A:ALA323
|
4.6
|
60.8
|
1.0
|
CE
|
A:LYS326
|
4.6
|
63.6
|
1.0
|
CD
|
A:LYS326
|
4.7
|
58.2
|
1.0
|
ND1
|
A:HIS291
|
4.7
|
62.0
|
1.0
|
CG
|
A:HIS291
|
4.8
|
56.8
|
1.0
|
|
Sodium binding site 6 out
of 8 in 7vuk
Go back to
Sodium Binding Sites List in 7vuk
Sodium binding site 6 out
of 8 in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 6 of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na503
b:33.6
occ:1.00
|
OE1
|
B:GLN336
|
3.3
|
59.2
|
1.0
|
N
|
B:VAL354
|
3.9
|
64.8
|
1.0
|
CD
|
B:GLN336
|
4.1
|
54.4
|
1.0
|
NE2
|
B:GLN336
|
4.1
|
52.4
|
1.0
|
O
|
B:ASP352
|
4.2
|
91.9
|
1.0
|
O
|
B:PRO351
|
4.3
|
88.6
|
1.0
|
CA
|
B:ARG353
|
4.3
|
62.5
|
1.0
|
CG2
|
B:VAL354
|
4.3
|
79.9
|
1.0
|
CD2
|
B:LEU333
|
4.5
|
40.5
|
1.0
|
C
|
B:ARG353
|
4.5
|
66.5
|
1.0
|
CB
|
B:VAL354
|
4.6
|
62.9
|
1.0
|
C
|
B:ASP352
|
4.7
|
73.7
|
1.0
|
N
|
B:ARG353
|
4.9
|
59.0
|
1.0
|
CA
|
B:VAL354
|
4.9
|
62.1
|
1.0
|
|
Sodium binding site 7 out
of 8 in 7vuk
Go back to
Sodium Binding Sites List in 7vuk
Sodium binding site 7 out
of 8 in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 7 of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na504
b:57.5
occ:1.00
|
O
|
B:GLY315
|
3.6
|
122.6
|
1.0
|
NZ
|
B:LYS433
|
3.6
|
68.2
|
1.0
|
O
|
B:GLY466
|
3.7
|
99.2
|
1.0
|
C
|
B:GLY315
|
4.0
|
101.3
|
1.0
|
CE2
|
B:TYR469
|
4.2
|
77.9
|
1.0
|
N
|
B:GLY315
|
4.3
|
86.4
|
1.0
|
N
|
B:PRO316
|
4.4
|
60.2
|
1.0
|
CD2
|
B:TYR469
|
4.4
|
73.2
|
1.0
|
CE
|
B:LYS433
|
4.6
|
64.9
|
1.0
|
C
|
B:GLY466
|
4.6
|
88.0
|
1.0
|
CA
|
B:GLY315
|
4.8
|
89.0
|
1.0
|
ND1
|
B:HIS428
|
4.8
|
63.8
|
1.0
|
CA
|
B:GLY466
|
4.9
|
81.1
|
1.0
|
CD
|
B:PRO316
|
4.9
|
68.4
|
1.0
|
CA
|
B:PRO316
|
4.9
|
69.0
|
1.0
|
O
|
B:HIS428
|
5.0
|
46.9
|
1.0
|
|
Sodium binding site 8 out
of 8 in 7vuk
Go back to
Sodium Binding Sites List in 7vuk
Sodium binding site 8 out
of 8 in the Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp.
Mono view
Stereo pair view
|
A full contact list of Sodium with other atoms in the Na binding
site number 8 of Crystal Structure of the Core Region of Thermus Thermophilus MUTS2 Complexed with Adp. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na505
b:26.0
occ:1.00
|
O
|
B:HOH609
|
2.5
|
44.9
|
1.0
|
NZ
|
B:LYS326
|
3.1
|
54.0
|
1.0
|
OE1
|
B:GLU9
|
3.1
|
47.0
|
1.0
|
OE2
|
B:GLU9
|
3.5
|
80.7
|
1.0
|
CD
|
B:GLU9
|
3.7
|
59.1
|
1.0
|
CD1
|
B:ILE294
|
3.9
|
84.5
|
1.0
|
CE1
|
B:HIS291
|
4.2
|
40.9
|
1.0
|
NE2
|
B:HIS291
|
4.2
|
49.0
|
1.0
|
O
|
B:HOH615
|
4.3
|
16.1
|
1.0
|
CE
|
B:LYS326
|
4.3
|
56.2
|
1.0
|
CG1
|
B:ILE294
|
4.6
|
69.0
|
1.0
|
ND1
|
B:HIS291
|
4.7
|
42.4
|
1.0
|
CD2
|
B:HIS291
|
4.8
|
51.6
|
1.0
|
CB
|
B:LEU293
|
4.9
|
40.2
|
1.0
|
CD
|
B:LYS326
|
5.0
|
55.0
|
1.0
|
|
Reference:
K.Fukui,
M.Inoue,
T.Murakawa,
S.Baba,
T.Kumasaka,
T.Yano.
Structural and Functional Insights Into the Mechanism By Which MUTS2 Recognizes A Dna Junction. Structure V. 30 973 2022.
ISSN: ISSN 0969-2126
PubMed: 35439431
DOI: 10.1016/J.STR.2022.03.014
Page generated: Wed Oct 9 09:22:15 2024
|