Potassium in PDB 3eu8: Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution
Protein crystallography data
The structure of Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution, PDB code: 3eu8
was solved by
Joint Center For Structural Genomics (Jcsg),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.59 /
2.12
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
58.180,
71.760,
221.790,
90.00,
92.30,
90.00
|
R / Rfree (%)
|
15.8 /
21.3
|
Other elements in 3eu8:
The structure of Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution also contains other interesting chemical elements:
Potassium Binding Sites:
The binding sites of Potassium atom in the Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution
(pdb code 3eu8). This binding sites where shown within
5.0 Angstroms radius around Potassium atom.
In total 5 binding sites of Potassium where determined in the
Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution, PDB code: 3eu8:
Jump to Potassium binding site number:
1;
2;
3;
4;
5;
Potassium binding site 1 out
of 5 in 3eu8
Go back to
Potassium Binding Sites List in 3eu8
Potassium binding site 1 out
of 5 in the Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 1 of Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K1
b:36.5
occ:1.00
|
O
|
A:THR35
|
2.6
|
31.7
|
1.0
|
O2
|
A:EDO459
|
2.7
|
38.7
|
1.0
|
O
|
A:SER32
|
2.8
|
20.6
|
1.0
|
O1
|
A:EDO459
|
2.9
|
38.0
|
1.0
|
O
|
A:HOH534
|
3.0
|
19.4
|
1.0
|
O
|
A:HOH584
|
3.0
|
20.8
|
1.0
|
OD1
|
B:ASP100
|
3.1
|
23.0
|
1.0
|
C
|
A:THR35
|
3.4
|
31.3
|
1.0
|
OH
|
B:TYR169
|
3.8
|
25.8
|
1.0
|
C1
|
A:EDO459
|
3.8
|
33.2
|
1.0
|
CB
|
A:THR35
|
3.8
|
30.9
|
1.0
|
C2
|
A:EDO459
|
3.8
|
37.7
|
1.0
|
O
|
A:SER36
|
3.9
|
27.1
|
1.0
|
C
|
A:SER32
|
4.0
|
23.3
|
1.0
|
CA
|
A:THR35
|
4.0
|
30.0
|
1.0
|
CG2
|
A:THR35
|
4.2
|
37.1
|
1.0
|
N
|
A:THR35
|
4.2
|
28.3
|
1.0
|
C
|
A:SER36
|
4.2
|
26.6
|
1.0
|
CG
|
B:ASP100
|
4.2
|
24.4
|
1.0
|
N
|
A:SER36
|
4.4
|
29.7
|
1.0
|
N
|
A:SER32
|
4.6
|
26.4
|
1.0
|
O
|
A:SER33
|
4.6
|
24.7
|
1.0
|
O
|
B:ASP100
|
4.6
|
22.1
|
1.0
|
CZ
|
B:TYR169
|
4.7
|
26.4
|
1.0
|
C
|
A:SER33
|
4.7
|
23.3
|
1.0
|
CA
|
A:SER33
|
4.7
|
21.8
|
1.0
|
N
|
A:LEU37
|
4.7
|
26.7
|
1.0
|
CA
|
A:SER36
|
4.8
|
28.8
|
1.0
|
N
|
A:SER33
|
4.8
|
22.8
|
1.0
|
CA
|
B:ASP100
|
4.8
|
22.3
|
1.0
|
CE1
|
B:TYR169
|
4.8
|
27.7
|
1.0
|
CA
|
A:SER32
|
5.0
|
26.5
|
1.0
|
OD2
|
B:ASP100
|
5.0
|
21.3
|
1.0
|
|
Potassium binding site 2 out
of 5 in 3eu8
Go back to
Potassium Binding Sites List in 3eu8
Potassium binding site 2 out
of 5 in the Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 2 of Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:K4
b:36.6
occ:1.00
|
O
|
A:HOH681
|
2.6
|
25.0
|
1.0
|
O
|
A:HOH667
|
2.8
|
25.0
|
1.0
|
O
|
B:SER32
|
2.8
|
21.0
|
1.0
|
O2
|
B:EDO8
|
2.8
|
31.1
|
1.0
|
O
|
B:THR35
|
2.8
|
33.0
|
1.0
|
OD1
|
A:ASP100
|
3.0
|
21.9
|
1.0
|
O1
|
B:EDO8
|
3.4
|
34.8
|
1.0
|
C
|
B:THR35
|
3.5
|
31.8
|
1.0
|
CB
|
B:THR35
|
3.6
|
31.0
|
1.0
|
OH
|
A:TYR169
|
3.7
|
32.3
|
1.0
|
C2
|
B:EDO8
|
3.7
|
27.1
|
1.0
|
C1
|
B:EDO8
|
3.8
|
24.9
|
1.0
|
O
|
B:SER36
|
3.8
|
27.9
|
1.0
|
CA
|
B:THR35
|
3.9
|
29.6
|
1.0
|
C
|
B:SER32
|
4.0
|
23.5
|
1.0
|
N
|
B:THR35
|
4.1
|
28.8
|
1.0
|
CG
|
A:ASP100
|
4.1
|
20.2
|
1.0
|
C
|
B:SER36
|
4.2
|
27.9
|
1.0
|
N
|
B:SER36
|
4.4
|
29.9
|
1.0
|
OG1
|
B:THR35
|
4.5
|
39.4
|
1.0
|
CG2
|
B:THR35
|
4.5
|
38.8
|
1.0
|
CZ
|
A:TYR169
|
4.5
|
27.5
|
1.0
|
N
|
B:SER32
|
4.5
|
25.6
|
1.0
|
CE1
|
A:TYR169
|
4.6
|
25.9
|
1.0
|
O
|
B:SER33
|
4.6
|
23.6
|
1.0
|
C
|
B:SER33
|
4.7
|
23.4
|
1.0
|
O
|
A:ASP100
|
4.7
|
22.8
|
1.0
|
N
|
B:LEU37
|
4.7
|
27.3
|
1.0
|
OD2
|
A:ASP100
|
4.8
|
19.1
|
1.0
|
CA
|
B:SER36
|
4.8
|
29.2
|
1.0
|
N
|
B:SER33
|
4.9
|
22.0
|
1.0
|
CA
|
A:ASP100
|
4.9
|
22.0
|
1.0
|
CA
|
B:SER33
|
4.9
|
20.8
|
1.0
|
CA
|
B:SER32
|
4.9
|
26.1
|
1.0
|
O
|
A:HOH961
|
4.9
|
38.2
|
1.0
|
|
Potassium binding site 3 out
of 5 in 3eu8
Go back to
Potassium Binding Sites List in 3eu8
Potassium binding site 3 out
of 5 in the Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 3 of Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:K3
b:41.5
occ:1.00
|
O1
|
C:EDO459
|
2.5
|
31.6
|
1.0
|
O
|
C:SER32
|
2.7
|
21.5
|
1.0
|
O
|
C:THR35
|
2.8
|
32.5
|
1.0
|
O
|
A:HOH702
|
3.1
|
27.6
|
1.0
|
O2
|
C:EDO459
|
3.2
|
47.3
|
1.0
|
C
|
C:THR35
|
3.6
|
30.9
|
1.0
|
C1
|
C:EDO459
|
3.7
|
46.5
|
1.0
|
CB
|
C:THR35
|
3.8
|
29.1
|
1.0
|
C
|
C:SER32
|
3.9
|
23.4
|
1.0
|
O
|
C:SER36
|
4.0
|
27.8
|
1.0
|
CG2
|
C:THR35
|
4.0
|
35.8
|
1.0
|
CA
|
C:THR35
|
4.1
|
30.4
|
1.0
|
C2
|
C:EDO459
|
4.1
|
37.3
|
1.0
|
N
|
C:THR35
|
4.2
|
28.9
|
1.0
|
C
|
C:SER36
|
4.4
|
27.2
|
1.0
|
N
|
C:SER32
|
4.5
|
26.6
|
1.0
|
N
|
C:SER36
|
4.6
|
29.4
|
1.0
|
O
|
C:SER33
|
4.7
|
23.5
|
1.0
|
C
|
C:SER33
|
4.7
|
23.9
|
1.0
|
CA
|
C:SER33
|
4.7
|
21.7
|
1.0
|
N
|
C:SER33
|
4.8
|
22.5
|
1.0
|
CA
|
C:SER32
|
4.9
|
26.0
|
1.0
|
N
|
C:LEU37
|
4.9
|
26.2
|
1.0
|
CA
|
C:SER36
|
5.0
|
28.9
|
1.0
|
|
Potassium binding site 4 out
of 5 in 3eu8
Go back to
Potassium Binding Sites List in 3eu8
Potassium binding site 4 out
of 5 in the Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 4 of Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:K5
b:60.5
occ:1.00
|
OH
|
C:TYR169
|
3.6
|
27.4
|
1.0
|
O
|
C:ILE99
|
3.8
|
19.2
|
1.0
|
O
|
C:ASP100
|
4.3
|
20.9
|
1.0
|
CA
|
C:ASP100
|
4.3
|
22.4
|
1.0
|
O
|
A:HOH579
|
4.3
|
21.0
|
1.0
|
C
|
C:ILE99
|
4.6
|
22.0
|
1.0
|
C
|
C:ASP100
|
4.6
|
21.9
|
1.0
|
CG
|
C:ARG106
|
4.7
|
31.2
|
1.0
|
OD1
|
C:ASP100
|
4.7
|
22.8
|
1.0
|
CG2
|
C:ILE99
|
4.8
|
18.6
|
1.0
|
CZ
|
C:TYR169
|
4.9
|
27.2
|
1.0
|
N
|
C:ASP100
|
4.9
|
23.3
|
1.0
|
CD
|
C:ARG106
|
5.0
|
32.9
|
1.0
|
|
Potassium binding site 5 out
of 5 in 3eu8
Go back to
Potassium Binding Sites List in 3eu8
Potassium binding site 5 out
of 5 in the Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 5 of Crystal Structure of Putative Glucoamylase (YP_210071.1) From Bacteroides Fragilis Nctc 9343 at 2.12 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:K2
b:40.8
occ:1.00
|
O
|
D:SER32
|
2.7
|
22.2
|
1.0
|
O
|
D:THR35
|
2.9
|
31.9
|
1.0
|
O
|
A:HOH676
|
3.0
|
24.9
|
1.0
|
C
|
D:THR35
|
3.7
|
31.2
|
1.0
|
CB
|
D:THR35
|
3.8
|
30.2
|
1.0
|
C
|
D:SER32
|
3.9
|
24.7
|
1.0
|
O
|
D:SER36
|
4.1
|
28.1
|
1.0
|
CA
|
D:THR35
|
4.1
|
30.8
|
1.0
|
N
|
D:THR35
|
4.3
|
28.8
|
1.0
|
CG2
|
D:THR35
|
4.4
|
37.1
|
1.0
|
N
|
D:SER32
|
4.5
|
27.6
|
1.0
|
C
|
D:SER36
|
4.5
|
27.3
|
1.0
|
CA
|
D:SER33
|
4.7
|
22.4
|
1.0
|
N
|
D:SER33
|
4.7
|
22.9
|
1.0
|
C
|
D:SER33
|
4.7
|
23.6
|
1.0
|
N
|
D:SER36
|
4.8
|
29.7
|
1.0
|
OG1
|
D:THR35
|
4.8
|
40.5
|
1.0
|
O
|
D:SER33
|
4.8
|
24.7
|
1.0
|
CA
|
D:SER32
|
4.8
|
26.8
|
1.0
|
N
|
D:LEU37
|
5.0
|
27.7
|
1.0
|
|
Reference:
Joint Center For Structural Genomics (Jcsg),
Joint Center For Structural Genomics (Jcsg).
N/A N/A.
Page generated: Mon Aug 12 08:08:43 2024
|