Sodium in PDB 5glm: Crystal Structure of COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form.
Protein crystallography data
The structure of Crystal Structure of COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form., PDB code: 5glm
was solved by
T.Matsuzawa,
N.Kishine,
Z.Fujimoto,
K.Yaoi,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
78.61 /
1.80
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
74.774,
61.647,
79.006,
90.00,
95.77,
90.00
|
R / Rfree (%)
|
14.5 /
16.9
|
Sodium Binding Sites:
The binding sites of Sodium atom in the Crystal Structure of COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form.
(pdb code 5glm). This binding sites where shown within
5.0 Angstroms radius around Sodium atom.
In total 4 binding sites of Sodium where determined in the
Crystal Structure of COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form., PDB code: 5glm:
Jump to Sodium binding site number:
1;
2;
3;
4;
Sodium binding site 1 out
of 4 in 5glm
Go back to
Sodium Binding Sites List in 5glm
Sodium binding site 1 out
of 4 in the Crystal Structure of COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form.
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 COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na410
b:18.4
occ:1.00
|
O
|
A:HOH1024
|
2.3
|
13.7
|
1.0
|
O
|
A:HOH1161
|
2.3
|
14.0
|
1.0
|
O
|
A:HOH1025
|
2.3
|
12.6
|
1.0
|
O
|
A:HOH1026
|
2.3
|
14.9
|
1.0
|
O
|
A:HOH1603
|
2.4
|
18.0
|
1.0
|
O
|
A:ALA270
|
3.2
|
11.5
|
1.0
|
NE2
|
A:HIS319
|
3.4
|
13.3
|
1.0
|
OG
|
A:SER59
|
3.8
|
12.8
|
1.0
|
CE3
|
A:TRP271
|
3.8
|
11.8
|
1.0
|
O
|
A:HOH1023
|
4.0
|
14.0
|
1.0
|
O
|
A:HIS320
|
4.1
|
11.1
|
1.0
|
C
|
A:ALA270
|
4.2
|
11.4
|
1.0
|
CD2
|
A:HIS319
|
4.2
|
13.4
|
1.0
|
CE1
|
A:HIS319
|
4.2
|
13.5
|
1.0
|
O
|
A:PRO178
|
4.4
|
12.0
|
1.0
|
C
|
A:ALA269
|
4.4
|
11.3
|
1.0
|
CB
|
A:ALA179
|
4.4
|
12.4
|
1.0
|
O
|
A:ALA269
|
4.4
|
10.9
|
1.0
|
CZ3
|
A:TRP271
|
4.5
|
11.9
|
1.0
|
O
|
A:HOH1274
|
4.5
|
16.8
|
1.0
|
CA
|
A:ALA269
|
4.6
|
11.4
|
1.0
|
CB
|
A:TRP271
|
4.7
|
11.6
|
1.0
|
N
|
A:ALA270
|
4.8
|
11.1
|
1.0
|
CD2
|
A:TRP271
|
4.8
|
11.7
|
1.0
|
CA
|
A:TRP271
|
4.9
|
11.5
|
1.0
|
N
|
A:TRP271
|
5.0
|
11.3
|
1.0
|
CB
|
A:ALA269
|
5.0
|
11.2
|
1.0
|
|
Sodium binding site 2 out
of 4 in 5glm
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Sodium Binding Sites List in 5glm
Sodium binding site 2 out
of 4 in the Crystal Structure of COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form.
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 COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na411
b:19.1
occ:1.00
|
OG1
|
A:THR363
|
2.3
|
13.7
|
1.0
|
O
|
A:HOH1412
|
2.4
|
25.3
|
1.0
|
O
|
A:HOH1244
|
2.4
|
22.5
|
1.0
|
O
|
A:HOH1344
|
2.5
|
15.5
|
1.0
|
O
|
A:HOH1243
|
2.5
|
16.2
|
1.0
|
O4B
|
B:XYP511
|
2.5
|
26.6
|
1.0
|
CB
|
A:THR363
|
3.6
|
13.8
|
1.0
|
C4B
|
B:XYP511
|
3.6
|
27.7
|
1.0
|
C5B
|
B:XYP511
|
3.8
|
27.9
|
1.0
|
O
|
A:HOH1293
|
3.9
|
41.0
|
1.0
|
O
|
B:HOH1345
|
4.0
|
19.8
|
1.0
|
O
|
A:HOH1299
|
4.0
|
38.0
|
1.0
|
O
|
A:HOH1292
|
4.1
|
24.1
|
1.0
|
C3B
|
B:XYP511
|
4.1
|
27.6
|
1.0
|
N
|
A:THR363
|
4.1
|
14.4
|
1.0
|
O
|
A:VAL308
|
4.1
|
12.5
|
1.0
|
O
|
B:HOH1580
|
4.2
|
34.7
|
1.0
|
O
|
A:ILE361
|
4.3
|
15.9
|
1.0
|
OD1
|
B:ASP263
|
4.3
|
18.8
|
1.0
|
CA
|
A:THR363
|
4.4
|
14.0
|
1.0
|
OD2
|
B:ASP263
|
4.4
|
20.4
|
1.0
|
N
|
A:VAL308
|
4.5
|
12.2
|
1.0
|
CG2
|
A:THR363
|
4.7
|
13.6
|
1.0
|
O3B
|
B:XYP511
|
4.7
|
28.6
|
1.0
|
CG
|
B:ASP263
|
4.8
|
19.0
|
1.0
|
|
Sodium binding site 3 out
of 4 in 5glm
Go back to
Sodium Binding Sites List in 5glm
Sodium binding site 3 out
of 4 in the Crystal Structure of COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form.
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 COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na410
b:20.4
occ:1.00
|
O
|
B:HOH1328
|
2.2
|
16.4
|
1.0
|
O
|
B:HOH1331
|
2.3
|
14.8
|
1.0
|
O
|
B:HOH1327
|
2.3
|
14.7
|
1.0
|
O
|
B:HOH1488
|
2.4
|
14.8
|
1.0
|
O
|
B:HOH1607
|
2.4
|
21.9
|
1.0
|
O
|
B:ALA270
|
3.2
|
13.3
|
1.0
|
NE2
|
B:HIS319
|
3.4
|
14.4
|
1.0
|
CE3
|
B:TRP271
|
3.8
|
13.7
|
1.0
|
OG
|
B:SER59
|
3.9
|
13.7
|
1.0
|
O
|
B:HOH1330
|
4.0
|
15.5
|
1.0
|
CE1
|
B:HIS319
|
4.2
|
14.7
|
1.0
|
O
|
B:HIS320
|
4.2
|
13.7
|
1.0
|
C
|
B:ALA270
|
4.2
|
13.2
|
1.0
|
CD2
|
B:HIS319
|
4.3
|
14.2
|
1.0
|
O
|
B:PRO178
|
4.3
|
14.8
|
1.0
|
C
|
B:ALA269
|
4.4
|
12.4
|
1.0
|
CB
|
B:ALA179
|
4.4
|
14.6
|
1.0
|
O
|
B:ALA269
|
4.4
|
12.2
|
1.0
|
CA
|
B:ALA269
|
4.5
|
12.3
|
1.0
|
CZ3
|
B:TRP271
|
4.5
|
13.7
|
1.0
|
O
|
B:HOH1489
|
4.6
|
17.6
|
1.0
|
CB
|
B:TRP271
|
4.7
|
13.5
|
1.0
|
N
|
B:ALA270
|
4.8
|
12.5
|
1.0
|
CD2
|
B:TRP271
|
4.8
|
13.5
|
1.0
|
CB
|
B:ALA269
|
4.9
|
12.5
|
1.0
|
CA
|
B:TRP271
|
5.0
|
13.7
|
1.0
|
|
Sodium binding site 4 out
of 4 in 5glm
Go back to
Sodium Binding Sites List in 5glm
Sodium binding site 4 out
of 4 in the Crystal Structure of COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form.
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 COXYL43, GH43 Beta-Xylosidase/Alpha- Arabinofuranosidase From A Compost Microbial Metagenome in Complex with Xylotriose, Calcium-Free Form. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na411
b:23.4
occ:1.00
|
O
|
B:HOH1572
|
2.4
|
35.3
|
1.0
|
O
|
B:HOH1235
|
2.4
|
28.9
|
1.0
|
O
|
B:HOH1315
|
2.4
|
27.1
|
1.0
|
O
|
B:HOH1407
|
2.4
|
22.4
|
1.0
|
OG1
|
B:THR363
|
2.5
|
17.4
|
1.0
|
O
|
B:HOH1153
|
2.5
|
19.9
|
1.0
|
CB
|
B:THR363
|
3.7
|
17.9
|
1.0
|
O
|
B:HOH1408
|
4.0
|
31.1
|
1.0
|
O
|
B:VAL308
|
4.1
|
15.0
|
1.0
|
N
|
B:THR363
|
4.2
|
18.6
|
1.0
|
O
|
B:HOH1406
|
4.2
|
23.0
|
1.0
|
O
|
B:ILE361
|
4.2
|
20.5
|
1.0
|
O
|
A:HOH1152
|
4.3
|
19.3
|
1.0
|
OD1
|
A:ASP263
|
4.3
|
16.9
|
1.0
|
OD2
|
A:ASP263
|
4.4
|
18.2
|
1.0
|
CA
|
B:THR363
|
4.5
|
18.0
|
1.0
|
O
|
A:HOH1155
|
4.5
|
39.4
|
1.0
|
N
|
B:VAL308
|
4.6
|
15.2
|
1.0
|
CG
|
A:ASP263
|
4.8
|
16.5
|
1.0
|
CG2
|
B:THR363
|
4.8
|
17.4
|
1.0
|
|
Reference:
T.Matsuzawa,
S.Kaneko,
N.Kishine,
Z.Fujimoto,
K.Yaoi.
Crystal Structure of Metagenomic Beta-Xylosidase/ Alpha-L-Arabinofuranosidase Activated By Calcium. J. Biochem. V. 162 173 2017.
ISSN: ISSN 1756-2651
PubMed: 28204531
DOI: 10.1093/JB/MVX012
Page generated: Mon Oct 7 21:12:52 2024
|