Potassium in PDB 6d1p: Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3
Protein crystallography data
The structure of Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3, PDB code: 6d1p
was solved by
W.G.Walton,
S.J.Pellock,
M.R.Redinbo,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.10 /
2.35
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
209.721,
68.209,
167.300,
90.00,
122.49,
90.00
|
R / Rfree (%)
|
17.6 /
22.2
|
Other elements in 6d1p:
The structure of Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3 also contains other interesting chemical elements:
Potassium Binding Sites:
The binding sites of Potassium atom in the Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3
(pdb code 6d1p). This binding sites where shown within
5.0 Angstroms radius around Potassium atom.
In total 4 binding sites of Potassium where determined in the
Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3, PDB code: 6d1p:
Jump to Potassium binding site number:
1;
2;
3;
4;
Potassium binding site 1 out
of 4 in 6d1p
Go back to
Potassium Binding Sites List in 6d1p
Potassium binding site 1 out
of 4 in the Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 1 of Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K908
b:20.6
occ:1.00
|
O
|
A:VAL83
|
2.8
|
21.6
|
1.0
|
O
|
A:ASP77
|
2.8
|
21.9
|
1.0
|
O
|
A:ASP80
|
2.8
|
26.7
|
1.0
|
O
|
A:HOH1152
|
2.9
|
12.5
|
1.0
|
O
|
A:ALA78
|
2.9
|
18.1
|
1.0
|
CD2
|
A:TYR593
|
3.3
|
20.8
|
1.0
|
CE2
|
A:TYR593
|
3.3
|
23.9
|
1.0
|
C
|
A:ALA78
|
3.5
|
17.2
|
1.0
|
CG
|
A:TYR593
|
3.6
|
20.9
|
1.0
|
CZ
|
A:TYR593
|
3.7
|
20.0
|
1.0
|
C
|
A:ASP80
|
3.9
|
21.9
|
1.0
|
N
|
A:ASP80
|
3.9
|
21.1
|
1.0
|
CD1
|
A:TYR593
|
4.0
|
18.5
|
1.0
|
C
|
A:VAL83
|
4.0
|
28.8
|
1.0
|
O
|
A:HOH1058
|
4.0
|
15.5
|
1.0
|
C
|
A:ASP77
|
4.0
|
22.2
|
1.0
|
CE1
|
A:TYR593
|
4.0
|
19.6
|
1.0
|
N
|
A:VAL79
|
4.1
|
15.8
|
1.0
|
N
|
A:TYR85
|
4.1
|
21.4
|
1.0
|
C
|
A:VAL79
|
4.2
|
22.4
|
1.0
|
CA
|
A:ALA78
|
4.2
|
16.8
|
1.0
|
CA
|
A:VAL79
|
4.3
|
17.6
|
1.0
|
CA
|
A:ASP80
|
4.4
|
20.5
|
1.0
|
CB
|
A:TYR593
|
4.4
|
19.3
|
1.0
|
OH
|
A:TYR593
|
4.5
|
23.0
|
1.0
|
CG2
|
A:VAL83
|
4.5
|
22.8
|
1.0
|
C
|
A:ASN84
|
4.6
|
22.0
|
1.0
|
CB
|
A:ASP80
|
4.6
|
24.6
|
1.0
|
CB
|
A:TYR85
|
4.6
|
19.8
|
1.0
|
N
|
A:ALA78
|
4.6
|
19.3
|
1.0
|
CA
|
A:TYR85
|
4.7
|
23.4
|
1.0
|
CA
|
A:ASN84
|
4.7
|
22.4
|
1.0
|
N
|
A:VAL83
|
4.7
|
22.3
|
1.0
|
N
|
A:ASN84
|
4.8
|
26.1
|
1.0
|
CA
|
A:VAL83
|
4.9
|
22.4
|
1.0
|
O
|
A:VAL79
|
4.9
|
22.7
|
1.0
|
N
|
A:PRO81
|
5.0
|
23.7
|
1.0
|
|
Potassium binding site 2 out
of 4 in 6d1p
Go back to
Potassium Binding Sites List in 6d1p
Potassium binding site 2 out
of 4 in the Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 2 of Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K909
b:21.4
occ:1.00
|
O
|
A:MET176
|
2.5
|
21.4
|
1.0
|
O
|
A:PRO178
|
2.6
|
19.6
|
1.0
|
O
|
A:HOH1024
|
2.6
|
22.9
|
1.0
|
O
|
A:ASP173
|
2.7
|
25.1
|
1.0
|
O
|
A:HOH1031
|
3.2
|
23.0
|
1.0
|
C
|
A:PRO178
|
3.6
|
20.2
|
1.0
|
C
|
A:MET176
|
3.6
|
22.0
|
1.0
|
C
|
A:ASP173
|
3.7
|
24.9
|
1.0
|
OD2
|
A:ASP180
|
3.8
|
21.2
|
1.0
|
CA
|
A:SER179
|
3.8
|
18.2
|
1.0
|
O
|
A:HOH1248
|
3.9
|
24.8
|
1.0
|
N
|
A:ASP180
|
3.9
|
18.9
|
1.0
|
CD2
|
A:LEU186
|
4.0
|
17.3
|
1.0
|
N
|
A:SER179
|
4.1
|
22.7
|
1.0
|
C
|
A:SER179
|
4.2
|
20.9
|
1.0
|
O
|
B:HOH1161
|
4.3
|
16.4
|
1.0
|
N
|
A:ASP173
|
4.3
|
22.9
|
1.0
|
CB
|
A:MET176
|
4.3
|
22.5
|
1.0
|
CA
|
A:MET176
|
4.3
|
24.4
|
1.0
|
CA
|
A:THR174
|
4.4
|
25.4
|
1.0
|
N
|
A:MET176
|
4.4
|
21.0
|
1.0
|
N
|
A:THR174
|
4.5
|
24.3
|
1.0
|
CA
|
A:ASP173
|
4.6
|
21.5
|
1.0
|
CG
|
A:ASP180
|
4.6
|
20.1
|
1.0
|
CE
|
A:MET176
|
4.6
|
16.9
|
1.0
|
N
|
A:ILE177
|
4.6
|
21.2
|
1.0
|
CA
|
A:ILE177
|
4.7
|
20.2
|
1.0
|
C
|
A:THR174
|
4.7
|
22.5
|
1.0
|
C
|
A:ILE177
|
4.8
|
22.4
|
1.0
|
CA
|
A:PRO178
|
4.8
|
21.8
|
1.0
|
N
|
A:PRO178
|
4.8
|
23.7
|
1.0
|
CA
|
A:ASP180
|
5.0
|
17.1
|
1.0
|
O
|
A:HOH1065
|
5.0
|
22.1
|
1.0
|
O
|
A:THR174
|
5.0
|
23.1
|
1.0
|
|
Potassium binding site 3 out
of 4 in 6d1p
Go back to
Potassium Binding Sites List in 6d1p
Potassium binding site 3 out
of 4 in the Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 3 of Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:K906
b:23.5
occ:1.00
|
O
|
B:VAL83
|
2.8
|
20.8
|
1.0
|
O
|
B:ASP77
|
2.8
|
20.8
|
1.0
|
O
|
B:ASP80
|
2.8
|
24.6
|
1.0
|
O
|
B:HOH1255
|
2.9
|
15.1
|
1.0
|
O
|
B:ALA78
|
2.9
|
21.4
|
1.0
|
CD2
|
B:TYR593
|
3.3
|
23.7
|
1.0
|
CE2
|
B:TYR593
|
3.4
|
22.5
|
1.0
|
C
|
B:ALA78
|
3.6
|
21.6
|
1.0
|
CG
|
B:TYR593
|
3.6
|
21.9
|
1.0
|
CZ
|
B:TYR593
|
3.7
|
23.6
|
1.0
|
O
|
B:HOH1154
|
3.8
|
23.2
|
1.0
|
C
|
B:ASP80
|
3.8
|
22.5
|
1.0
|
N
|
B:ASP80
|
3.9
|
21.4
|
1.0
|
C
|
B:ASP77
|
3.9
|
20.6
|
1.0
|
CD1
|
B:TYR593
|
4.0
|
21.0
|
1.0
|
C
|
B:VAL83
|
4.0
|
26.3
|
1.0
|
CE1
|
B:TYR593
|
4.0
|
21.6
|
1.0
|
N
|
B:TYR85
|
4.1
|
21.6
|
1.0
|
N
|
B:VAL79
|
4.2
|
17.5
|
1.0
|
CA
|
B:ALA78
|
4.2
|
18.9
|
1.0
|
C
|
B:VAL79
|
4.3
|
23.1
|
1.0
|
CA
|
B:ASP80
|
4.3
|
20.3
|
1.0
|
CB
|
B:TYR593
|
4.4
|
22.1
|
1.0
|
CA
|
B:VAL79
|
4.4
|
20.4
|
1.0
|
CG2
|
B:VAL83
|
4.5
|
22.7
|
1.0
|
OH
|
B:TYR593
|
4.5
|
25.9
|
1.0
|
CB
|
B:ASP80
|
4.5
|
24.0
|
1.0
|
N
|
B:ALA78
|
4.6
|
23.4
|
1.0
|
C
|
B:ASN84
|
4.7
|
23.3
|
1.0
|
CA
|
B:ASN84
|
4.7
|
21.8
|
1.0
|
CB
|
B:TYR85
|
4.7
|
23.6
|
1.0
|
N
|
B:VAL83
|
4.7
|
23.9
|
1.0
|
CA
|
B:TYR85
|
4.7
|
19.6
|
1.0
|
N
|
B:ASN84
|
4.8
|
23.9
|
1.0
|
CA
|
B:VAL83
|
4.9
|
26.4
|
1.0
|
N
|
B:PRO81
|
4.9
|
25.0
|
1.0
|
|
Potassium binding site 4 out
of 4 in 6d1p
Go back to
Potassium Binding Sites List in 6d1p
Potassium binding site 4 out
of 4 in the Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 4 of Apo Structure of Bacteroides Uniformis Beta-Glucuronidase 3 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:K907
b:27.8
occ:1.00
|
O
|
B:PRO178
|
2.5
|
27.4
|
1.0
|
O
|
B:MET176
|
2.6
|
23.8
|
1.0
|
O
|
B:ASP173
|
2.6
|
25.6
|
1.0
|
O
|
B:HOH1178
|
2.9
|
21.9
|
1.0
|
O
|
B:HOH1314
|
3.1
|
24.3
|
1.0
|
C
|
B:PRO178
|
3.6
|
27.5
|
1.0
|
C
|
B:ASP173
|
3.7
|
26.4
|
1.0
|
C
|
B:MET176
|
3.7
|
27.4
|
1.0
|
CA
|
B:SER179
|
3.9
|
26.7
|
1.0
|
OD2
|
B:ASP180
|
3.9
|
26.3
|
1.0
|
N
|
B:ASP180
|
3.9
|
22.8
|
1.0
|
O
|
B:HOH1223
|
3.9
|
29.1
|
1.0
|
O
|
B:HOH1051
|
4.0
|
24.3
|
1.0
|
CD2
|
B:LEU186
|
4.1
|
20.7
|
1.0
|
N
|
B:SER179
|
4.2
|
28.5
|
1.0
|
C
|
B:SER179
|
4.2
|
27.6
|
1.0
|
N
|
B:ASP173
|
4.4
|
25.1
|
1.0
|
CE
|
B:MET176
|
4.4
|
21.9
|
1.0
|
CA
|
B:MET176
|
4.4
|
25.6
|
1.0
|
CB
|
B:MET176
|
4.5
|
25.1
|
1.0
|
N
|
B:THR174
|
4.5
|
25.9
|
1.0
|
CA
|
B:THR174
|
4.5
|
25.6
|
1.0
|
N
|
B:MET176
|
4.5
|
26.4
|
1.0
|
CG
|
B:ASP180
|
4.5
|
25.7
|
1.0
|
CA
|
B:ASP173
|
4.6
|
25.4
|
1.0
|
N
|
B:ILE177
|
4.6
|
25.9
|
1.0
|
C
|
B:THR174
|
4.7
|
31.5
|
1.0
|
CA
|
B:ILE177
|
4.7
|
25.7
|
1.0
|
O
|
B:THR174
|
4.7
|
33.9
|
1.0
|
CA
|
B:PRO178
|
4.8
|
26.1
|
1.0
|
N
|
B:PRO178
|
4.8
|
26.9
|
1.0
|
C
|
B:ILE177
|
4.8
|
25.6
|
1.0
|
O
|
B:HOH1036
|
4.8
|
27.2
|
1.0
|
CA
|
B:ASP180
|
5.0
|
26.2
|
1.0
|
|
Reference:
S.J.Pellock,
W.G.Walton,
K.A.Biernat,
D.Torres-Rivera,
B.C.Creekmore,
Y.Xu,
J.Liu,
A.Tripathy,
L.J.Stewart,
M.R.Redinbo.
Three Structurally and Functionally Distinct Beta-Glucuronidases From the Human Gut Microbebacteroides Uniformis. J. Biol. Chem. V. 293 18559 2018.
ISSN: ESSN 1083-351X
PubMed: 30301767
DOI: 10.1074/JBC.RA118.005414
Page generated: Mon Aug 12 15:42:36 2024
|