Potassium in PDB 4bgb: Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri
Protein crystallography data
The structure of Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri, PDB code: 4bgb
was solved by
M.Schacherl,
U.Baumann,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
45.147 /
1.34
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
54.790,
108.540,
117.350,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
15.76 /
18.28
|
Other elements in 4bgb:
The structure of Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri also contains other interesting chemical elements:
Potassium Binding Sites:
The binding sites of Potassium atom in the Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri
(pdb code 4bgb). This binding sites where shown within
5.0 Angstroms radius around Potassium atom.
In total 5 binding sites of Potassium where determined in the
Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri, PDB code: 4bgb:
Jump to Potassium binding site number:
1;
2;
3;
4;
5;
Potassium binding site 1 out
of 5 in 4bgb
Go back to
Potassium Binding Sites List in 4bgb
Potassium binding site 1 out
of 5 in the Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 1 of Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K1356
b:18.1
occ:1.00
|
OD2
|
A:ASP138
|
2.7
|
35.4
|
1.0
|
O
|
A:ALA142
|
2.8
|
20.1
|
1.0
|
O
|
A:GLY183
|
2.9
|
24.7
|
1.0
|
O
|
A:HOH2143
|
3.0
|
65.4
|
1.0
|
O
|
A:ALA185
|
3.0
|
19.4
|
1.0
|
O
|
A:PHE182
|
3.1
|
19.3
|
1.0
|
C
|
A:GLY183
|
3.6
|
22.2
|
1.0
|
CG
|
A:ASP138
|
3.6
|
21.8
|
1.0
|
CB
|
A:SER243
|
3.7
|
18.2
|
1.0
|
CB
|
A:ASP138
|
3.8
|
20.0
|
1.0
|
CA
|
A:GLY183
|
4.0
|
21.7
|
1.0
|
C
|
A:ALA142
|
4.0
|
16.8
|
1.0
|
C
|
A:ALA185
|
4.0
|
17.7
|
1.0
|
N
|
A:ALA185
|
4.0
|
16.7
|
1.0
|
O
|
A:HOH2141
|
4.1
|
27.7
|
1.0
|
C
|
A:PHE182
|
4.2
|
22.8
|
1.0
|
O
|
A:HOH2098
|
4.2
|
38.3
|
1.0
|
CD
|
A:PRO143
|
4.3
|
19.0
|
1.0
|
C
|
A:ASP184
|
4.4
|
17.6
|
1.0
|
OG
|
A:SER243
|
4.5
|
18.7
|
1.0
|
CA
|
A:ALA185
|
4.5
|
17.0
|
1.0
|
N
|
A:ASP184
|
4.5
|
20.1
|
1.0
|
N
|
A:GLY183
|
4.6
|
19.9
|
1.0
|
N
|
A:ALA142
|
4.7
|
20.4
|
1.0
|
N
|
A:PRO143
|
4.7
|
18.0
|
1.0
|
OD1
|
A:ASP138
|
4.7
|
20.3
|
1.0
|
CB
|
A:ALA185
|
4.8
|
15.8
|
1.0
|
CA
|
A:SER243
|
4.8
|
17.5
|
1.0
|
CA
|
A:ASP184
|
4.8
|
19.6
|
1.0
|
O
|
A:ASP184
|
5.0
|
18.8
|
1.0
|
O
|
A:HOH2140
|
5.0
|
43.9
|
1.0
|
|
Potassium binding site 2 out
of 5 in 4bgb
Go back to
Potassium Binding Sites List in 4bgb
Potassium binding site 2 out
of 5 in the Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 2 of Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K1357
b:32.8
occ:0.45
|
K
|
A:K1357
|
0.0
|
32.8
|
0.5
|
O
|
A:HOH2084
|
2.0
|
30.0
|
0.5
|
K
|
A:K1357
|
2.1
|
15.1
|
0.5
|
O
|
A:GLY141
|
2.3
|
30.8
|
1.0
|
OD1
|
A:ASP144
|
2.6
|
27.6
|
1.0
|
OD2
|
A:ASP144
|
2.6
|
25.9
|
1.0
|
O
|
A:HOH2100
|
2.8
|
45.4
|
1.0
|
CG
|
A:ASP144
|
2.9
|
23.8
|
1.0
|
O
|
A:HOH2085
|
3.4
|
58.2
|
1.0
|
C
|
A:GLY141
|
3.5
|
24.2
|
1.0
|
CA
|
A:ALA142
|
4.3
|
19.7
|
1.0
|
N
|
A:ALA142
|
4.3
|
20.4
|
1.0
|
CB
|
A:ASP144
|
4.3
|
20.1
|
1.0
|
O
|
A:PRO143
|
4.4
|
18.0
|
1.0
|
O
|
A:ASP138
|
4.4
|
19.7
|
1.0
|
CA
|
A:GLY141
|
4.5
|
21.6
|
1.0
|
C
|
A:PRO143
|
4.7
|
17.4
|
1.0
|
CA
|
A:ASP144
|
4.7
|
16.2
|
1.0
|
OD2
|
A:ASP114
|
4.8
|
18.8
|
1.0
|
N
|
A:GLY141
|
4.8
|
20.5
|
1.0
|
N
|
A:ASP144
|
4.8
|
17.1
|
1.0
|
O1
|
A:GOL1353
|
4.9
|
29.5
|
1.0
|
CB
|
A:ALA142
|
5.0
|
19.5
|
1.0
|
OE1
|
A:GLU115
|
5.0
|
31.9
|
1.0
|
N
|
A:ASP114
|
5.0
|
14.9
|
1.0
|
|
Potassium binding site 3 out
of 5 in 4bgb
Go back to
Potassium Binding Sites List in 4bgb
Potassium binding site 3 out
of 5 in the Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 3 of Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K1357
b:15.1
occ:0.53
|
K
|
A:K1357
|
0.0
|
15.1
|
0.5
|
K
|
A:K1357
|
2.1
|
32.8
|
0.5
|
O
|
A:ASP138
|
2.8
|
19.7
|
1.0
|
O
|
A:GLY141
|
2.8
|
30.8
|
1.0
|
O
|
A:HOH2085
|
3.0
|
58.2
|
1.0
|
OD2
|
A:ASP144
|
3.1
|
25.9
|
1.0
|
OD2
|
A:ASP114
|
3.2
|
18.8
|
1.0
|
O
|
A:HOH2084
|
3.4
|
30.0
|
0.5
|
CG
|
A:ASP144
|
3.4
|
23.8
|
1.0
|
O
|
A:PRO143
|
3.4
|
18.0
|
1.0
|
OD1
|
A:ASP144
|
3.5
|
27.6
|
1.0
|
C
|
A:ASP138
|
3.7
|
20.2
|
1.0
|
CG
|
A:ASP114
|
3.8
|
16.9
|
1.0
|
C
|
A:GLY141
|
3.8
|
24.2
|
1.0
|
CB
|
A:ASP114
|
4.1
|
16.2
|
1.0
|
CA
|
A:ASP144
|
4.1
|
16.2
|
1.0
|
C
|
A:PRO143
|
4.2
|
17.4
|
1.0
|
N
|
A:ASP138
|
4.2
|
16.6
|
1.0
|
CB
|
A:ASP144
|
4.3
|
20.1
|
1.0
|
CA
|
A:PRO139
|
4.4
|
20.3
|
1.0
|
N
|
A:GLY141
|
4.5
|
20.5
|
1.0
|
N
|
A:ASP144
|
4.5
|
17.1
|
1.0
|
CA
|
A:ASP138
|
4.5
|
16.6
|
1.0
|
N
|
A:PRO139
|
4.6
|
18.0
|
1.0
|
C
|
A:PRO139
|
4.6
|
19.9
|
1.0
|
N
|
A:ALA142
|
4.6
|
20.4
|
1.0
|
CA
|
A:ALA142
|
4.6
|
19.7
|
1.0
|
OD1
|
A:ASP114
|
4.7
|
16.0
|
1.0
|
CA
|
A:GLY141
|
4.7
|
21.6
|
1.0
|
O
|
A:HOH2100
|
4.7
|
45.4
|
1.0
|
O
|
A:PRO139
|
4.8
|
22.6
|
1.0
|
N
|
A:GLY137
|
4.8
|
14.6
|
1.0
|
C
|
A:GLY137
|
4.9
|
16.3
|
1.0
|
CB
|
A:ASP138
|
4.9
|
20.0
|
1.0
|
|
Potassium binding site 4 out
of 5 in 4bgb
Go back to
Potassium Binding Sites List in 4bgb
Potassium binding site 4 out
of 5 in the Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 4 of Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:K1357
b:26.0
occ:0.68
|
O
|
B:ASP138
|
2.6
|
23.2
|
1.0
|
O
|
B:HOH2117
|
2.8
|
26.3
|
1.0
|
O
|
B:HOH2095
|
2.8
|
28.2
|
1.0
|
OD2
|
B:ASP114
|
2.9
|
21.1
|
1.0
|
O
|
B:GLY141
|
3.0
|
25.9
|
1.0
|
OD2
|
B:ASP144
|
3.1
|
22.3
|
1.0
|
CG
|
B:ASP144
|
3.4
|
17.3
|
1.0
|
O
|
B:PRO143
|
3.4
|
21.0
|
1.0
|
OD1
|
B:ASP144
|
3.5
|
17.4
|
1.0
|
C
|
B:ASP138
|
3.5
|
17.4
|
1.0
|
CG
|
B:ASP114
|
3.7
|
16.7
|
1.0
|
C
|
B:GLY141
|
3.9
|
21.5
|
1.0
|
CB
|
B:ASP114
|
4.0
|
13.6
|
1.0
|
N
|
B:ASP138
|
4.2
|
14.5
|
1.0
|
CA
|
B:PRO139
|
4.2
|
19.8
|
1.0
|
C
|
B:PRO143
|
4.2
|
16.6
|
1.0
|
CA
|
B:ASP144
|
4.3
|
12.3
|
1.0
|
N
|
B:PRO139
|
4.3
|
17.7
|
1.0
|
CB
|
B:ASP144
|
4.3
|
14.4
|
1.0
|
CA
|
B:ASP138
|
4.4
|
14.6
|
1.0
|
CA
|
B:ALA142
|
4.5
|
15.5
|
1.0
|
N
|
B:ALA142
|
4.6
|
17.5
|
1.0
|
N
|
B:ASP144
|
4.6
|
13.2
|
1.0
|
C
|
B:PRO139
|
4.6
|
19.1
|
1.0
|
N
|
B:GLY141
|
4.7
|
18.8
|
1.0
|
OD1
|
B:ASP114
|
4.8
|
14.1
|
1.0
|
C
|
B:GLY137
|
4.8
|
14.9
|
1.0
|
N
|
B:GLY137
|
4.9
|
12.1
|
1.0
|
O
|
B:PRO139
|
4.9
|
21.8
|
1.0
|
N
|
B:ASP114
|
4.9
|
12.3
|
1.0
|
CA
|
B:GLY141
|
4.9
|
21.0
|
1.0
|
CB
|
B:ASP138
|
5.0
|
15.2
|
1.0
|
|
Potassium binding site 5 out
of 5 in 4bgb
Go back to
Potassium Binding Sites List in 4bgb
Potassium binding site 5 out
of 5 in the Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 5 of Nucleotide-Bound Closed Form of A Putative Sugar Kinase MK0840 From Methanopyrus Kandleri within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:K1358
b:16.1
occ:1.00
|
O
|
B:ALA142
|
2.7
|
16.7
|
1.0
|
O
|
B:GLY183
|
2.9
|
22.0
|
1.0
|
OG
|
B:SER243
|
2.9
|
34.7
|
1.0
|
O
|
B:ALA185
|
3.0
|
15.6
|
1.0
|
OD2
|
B:ASP138
|
3.1
|
18.9
|
1.0
|
O
|
B:PHE182
|
3.2
|
15.7
|
1.0
|
C
|
B:GLY183
|
3.5
|
17.8
|
1.0
|
C
|
B:ALA142
|
3.8
|
14.3
|
1.0
|
CB
|
B:SER243
|
3.9
|
27.1
|
1.0
|
CG
|
B:ASP138
|
3.9
|
16.4
|
1.0
|
N
|
B:ALA185
|
3.9
|
13.1
|
1.0
|
O
|
B:HOH2145
|
4.0
|
54.4
|
1.0
|
C
|
B:ALA185
|
4.0
|
14.2
|
1.0
|
CA
|
B:GLY183
|
4.0
|
17.3
|
1.0
|
O
|
B:HOH2112
|
4.1
|
33.3
|
1.0
|
CB
|
B:ASP138
|
4.1
|
15.2
|
1.0
|
C
|
B:PHE182
|
4.2
|
16.8
|
1.0
|
N
|
B:ASP184
|
4.3
|
17.1
|
1.0
|
N
|
B:ALA142
|
4.3
|
17.5
|
1.0
|
C
|
B:ASP184
|
4.4
|
16.0
|
1.0
|
CA
|
B:ALA185
|
4.4
|
13.4
|
1.0
|
O
|
B:HOH2144
|
4.5
|
38.7
|
1.0
|
CD
|
B:PRO143
|
4.5
|
13.8
|
1.0
|
N
|
B:PRO143
|
4.6
|
12.8
|
1.0
|
N
|
B:GLY183
|
4.6
|
16.1
|
1.0
|
CA
|
B:ASP184
|
4.6
|
18.2
|
1.0
|
CB
|
B:ALA185
|
4.7
|
12.9
|
1.0
|
CA
|
B:SER243
|
4.8
|
20.1
|
1.0
|
CA
|
B:ALA142
|
4.8
|
15.5
|
1.0
|
|
Reference:
M.Schacherl,
S.M.Waltersperger,
U.Baumann.
Structural Characterization of the Ribonuclease H-Like Type Askha Superfamily Kinase MK0840 From Methanopyrus Kandleri Acta Crystallogr.,Sect.D V. 69 2440 2013.
ISSN: ISSN 0907-4449
PubMed: 24311585
DOI: 10.1107/S0907444913022683
Page generated: Mon Aug 12 10:11:55 2024
|