Sodium in PDB 5jyd: Crystal Structure of A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia
Protein crystallography data
The structure of Crystal Structure of A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia, PDB code: 5jyd
was solved by
Seattle Structural Genomics Center For Infectious Disease,
Seattlestructural Genomics Center For Infectious Disease (Ssgcid),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
48.94 /
1.65
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
86.800,
107.820,
117.690,
90.00,
97.63,
90.00
|
R / Rfree (%)
|
14.1 /
17.4
|
Other elements in 5jyd:
The structure of Crystal Structure of A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia also contains other interesting chemical elements:
Sodium Binding Sites:
The binding sites of Sodium atom in the Crystal Structure of A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia
(pdb code 5jyd). 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 A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia, PDB code: 5jyd:
Jump to Sodium binding site number:
1;
2;
3;
4;
Sodium binding site 1 out
of 4 in 5jyd
Go back to
Sodium Binding Sites List in 5jyd
Sodium binding site 1 out
of 4 in the Crystal Structure of A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia
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 A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na910
b:10.8
occ:1.00
|
O
|
B:VAL304
|
2.2
|
11.1
|
1.0
|
O
|
A:VAL304
|
2.2
|
8.7
|
1.0
|
O
|
B:HOH1204
|
2.3
|
12.6
|
1.0
|
O
|
A:PHE314
|
2.5
|
12.5
|
1.0
|
O
|
B:PHE314
|
2.5
|
10.2
|
1.0
|
C
|
A:PHE314
|
3.3
|
14.2
|
1.0
|
C
|
B:PHE314
|
3.4
|
12.3
|
1.0
|
C
|
B:VAL304
|
3.4
|
10.2
|
1.0
|
C
|
A:VAL304
|
3.5
|
7.6
|
1.0
|
CA
|
A:PHE314
|
3.9
|
11.2
|
1.0
|
CA
|
B:PHE314
|
4.0
|
10.2
|
1.0
|
CG2
|
A:VAL304
|
4.0
|
7.8
|
0.2
|
CB
|
A:PHE314
|
4.0
|
11.5
|
1.0
|
CB
|
B:PHE314
|
4.0
|
12.0
|
1.0
|
CA
|
A:TRP305
|
4.2
|
8.8
|
1.0
|
CA
|
B:TRP305
|
4.2
|
9.0
|
1.0
|
OXT
|
A:PHE314
|
4.2
|
12.8
|
1.0
|
N
|
B:TRP305
|
4.3
|
10.1
|
1.0
|
OXT
|
B:PHE314
|
4.3
|
11.9
|
1.0
|
N
|
A:TRP305
|
4.3
|
10.2
|
1.0
|
CA
|
B:VAL304
|
4.4
|
9.2
|
1.0
|
N
|
A:GLY306
|
4.5
|
8.0
|
1.0
|
CA
|
A:VAL304
|
4.5
|
8.6
|
0.2
|
N
|
B:GLY306
|
4.5
|
10.7
|
1.0
|
CA
|
A:VAL304
|
4.5
|
8.2
|
0.8
|
CB
|
B:VAL304
|
4.5
|
10.7
|
1.0
|
CB
|
A:VAL304
|
4.6
|
10.0
|
0.8
|
N
|
B:VAL304
|
4.6
|
10.2
|
1.0
|
CD1
|
B:TRP305
|
4.6
|
10.3
|
1.0
|
CB
|
A:VAL304
|
4.7
|
9.7
|
0.2
|
N
|
A:VAL304
|
4.7
|
8.2
|
1.0
|
CD1
|
A:TRP305
|
4.7
|
9.1
|
1.0
|
O
|
B:HOH1081
|
4.7
|
15.7
|
1.0
|
O
|
A:HOH1143
|
4.8
|
19.7
|
1.0
|
CD1
|
B:PHE314
|
4.8
|
10.4
|
1.0
|
C
|
A:TRP305
|
4.8
|
9.2
|
1.0
|
CD1
|
A:PHE314
|
4.9
|
9.7
|
1.0
|
C
|
B:TRP305
|
4.9
|
10.4
|
1.0
|
CG
|
B:PHE314
|
5.0
|
11.9
|
1.0
|
CG
|
A:PHE314
|
5.0
|
9.8
|
1.0
|
|
Sodium binding site 2 out
of 4 in 5jyd
Go back to
Sodium Binding Sites List in 5jyd
Sodium binding site 2 out
of 4 in the Crystal Structure of A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia
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 A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Na909
b:10.6
occ:1.00
|
O
|
C:VAL304
|
2.2
|
8.9
|
1.0
|
O
|
D:VAL304
|
2.2
|
9.4
|
1.0
|
O
|
D:HOH1252
|
2.3
|
11.0
|
1.0
|
O
|
D:PHE314
|
2.5
|
10.5
|
1.0
|
O
|
C:PHE314
|
2.5
|
10.4
|
1.0
|
C
|
C:PHE314
|
3.4
|
8.9
|
1.0
|
C
|
D:PHE314
|
3.4
|
12.2
|
1.0
|
C
|
D:VAL304
|
3.5
|
7.7
|
1.0
|
C
|
C:VAL304
|
3.5
|
6.7
|
1.0
|
CA
|
C:PHE314
|
3.9
|
8.6
|
1.0
|
CA
|
D:PHE314
|
4.0
|
8.7
|
1.0
|
CB
|
C:PHE314
|
4.0
|
9.7
|
1.0
|
CB
|
D:PHE314
|
4.1
|
11.3
|
1.0
|
CA
|
C:TRP305
|
4.2
|
7.2
|
1.0
|
CA
|
D:TRP305
|
4.3
|
7.0
|
1.0
|
OXT
|
D:PHE314
|
4.3
|
11.3
|
1.0
|
OXT
|
C:PHE314
|
4.3
|
10.5
|
1.0
|
N
|
D:TRP305
|
4.3
|
8.8
|
1.0
|
N
|
C:TRP305
|
4.3
|
8.5
|
1.0
|
CA
|
D:VAL304
|
4.4
|
7.1
|
1.0
|
CA
|
C:VAL304
|
4.4
|
7.0
|
1.0
|
N
|
C:GLY306
|
4.5
|
8.0
|
1.0
|
N
|
D:GLY306
|
4.5
|
7.7
|
1.0
|
CB
|
D:VAL304
|
4.6
|
8.9
|
1.0
|
CB
|
C:VAL304
|
4.6
|
11.1
|
1.0
|
N
|
C:VAL304
|
4.6
|
6.5
|
1.0
|
N
|
D:VAL304
|
4.6
|
7.4
|
1.0
|
CD1
|
D:TRP305
|
4.7
|
6.8
|
1.0
|
CD1
|
C:TRP305
|
4.7
|
8.7
|
1.0
|
O
|
D:HOH1068
|
4.8
|
17.3
|
1.0
|
O
|
C:HOH1086
|
4.8
|
18.7
|
1.0
|
CD1
|
D:PHE314
|
4.8
|
11.2
|
1.0
|
CD1
|
C:PHE314
|
4.9
|
10.2
|
1.0
|
C
|
C:TRP305
|
4.9
|
7.8
|
1.0
|
C
|
D:TRP305
|
4.9
|
7.2
|
1.0
|
CG
|
C:PHE314
|
5.0
|
8.5
|
1.0
|
CG
|
D:PHE314
|
5.0
|
9.4
|
1.0
|
|
Sodium binding site 3 out
of 4 in 5jyd
Go back to
Sodium Binding Sites List in 5jyd
Sodium binding site 3 out
of 4 in the Crystal Structure of A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia
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 A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Na913
b:11.5
occ:1.00
|
O
|
F:VAL304
|
2.2
|
13.6
|
1.0
|
O
|
E:VAL304
|
2.2
|
10.0
|
1.0
|
O
|
F:HOH1170
|
2.3
|
13.8
|
1.0
|
O
|
F:PHE314
|
2.5
|
15.2
|
1.0
|
O
|
E:PHE314
|
2.5
|
12.1
|
1.0
|
C
|
E:PHE314
|
3.4
|
12.7
|
1.0
|
C
|
F:PHE314
|
3.4
|
15.4
|
1.0
|
C
|
F:VAL304
|
3.4
|
14.3
|
1.0
|
C
|
E:VAL304
|
3.4
|
9.2
|
1.0
|
CA
|
F:PHE314
|
4.0
|
12.2
|
1.0
|
CA
|
E:PHE314
|
4.0
|
10.3
|
1.0
|
CB
|
F:PHE314
|
4.0
|
12.8
|
1.0
|
CB
|
E:PHE314
|
4.1
|
12.5
|
1.0
|
CA
|
E:TRP305
|
4.2
|
12.4
|
1.0
|
CA
|
F:TRP305
|
4.2
|
9.6
|
1.0
|
OXT
|
E:PHE314
|
4.2
|
13.8
|
1.0
|
N
|
E:TRP305
|
4.3
|
10.6
|
1.0
|
N
|
F:TRP305
|
4.3
|
11.1
|
1.0
|
OXT
|
F:PHE314
|
4.3
|
15.3
|
1.0
|
CA
|
F:VAL304
|
4.4
|
12.8
|
1.0
|
CA
|
E:VAL304
|
4.5
|
9.0
|
1.0
|
N
|
F:GLY306
|
4.5
|
11.2
|
1.0
|
N
|
E:GLY306
|
4.5
|
11.0
|
1.0
|
CB
|
F:VAL304
|
4.5
|
16.2
|
1.0
|
CB
|
E:VAL304
|
4.6
|
13.9
|
1.0
|
N
|
F:VAL304
|
4.6
|
13.6
|
1.0
|
N
|
E:VAL304
|
4.6
|
9.6
|
1.0
|
CD1
|
E:TRP305
|
4.7
|
11.2
|
1.0
|
CD1
|
F:TRP305
|
4.7
|
10.5
|
1.0
|
O
|
F:HOH1088
|
4.8
|
20.2
|
1.0
|
O
|
E:HOH1053
|
4.8
|
20.2
|
1.0
|
CD1
|
F:PHE314
|
4.8
|
12.0
|
1.0
|
C
|
F:TRP305
|
4.8
|
12.9
|
1.0
|
C
|
E:TRP305
|
4.9
|
10.3
|
1.0
|
CD1
|
E:PHE314
|
4.9
|
16.2
|
1.0
|
CG
|
F:PHE314
|
5.0
|
12.5
|
1.0
|
|
Sodium binding site 4 out
of 4 in 5jyd
Go back to
Sodium Binding Sites List in 5jyd
Sodium binding site 4 out
of 4 in the Crystal Structure of A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia
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 A Putative Short Chain Dehydrogenase From Burkholderia Cenocepacia within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Na910
b:16.4
occ:1.00
|
O
|
H:VAL304
|
2.2
|
16.4
|
1.0
|
O
|
G:VAL304
|
2.3
|
13.7
|
1.0
|
O
|
G:HOH1211
|
2.4
|
15.1
|
1.0
|
O
|
H:PHE314
|
2.4
|
14.3
|
1.0
|
O
|
G:PHE314
|
2.5
|
18.2
|
1.0
|
C
|
H:PHE314
|
3.3
|
17.6
|
1.0
|
C
|
G:PHE314
|
3.4
|
15.6
|
1.0
|
C
|
H:VAL304
|
3.4
|
18.1
|
1.0
|
C
|
G:VAL304
|
3.5
|
14.2
|
1.0
|
CA
|
H:PHE314
|
3.9
|
15.4
|
1.0
|
CA
|
G:PHE314
|
4.0
|
15.9
|
1.0
|
CB
|
H:PHE314
|
4.0
|
19.5
|
1.0
|
OXT
|
H:PHE314
|
4.2
|
16.4
|
1.0
|
CB
|
G:PHE314
|
4.2
|
16.3
|
1.0
|
CA
|
H:TRP305
|
4.2
|
18.4
|
1.0
|
CA
|
G:TRP305
|
4.2
|
16.2
|
1.0
|
OXT
|
G:PHE314
|
4.3
|
18.6
|
1.0
|
N
|
H:TRP305
|
4.3
|
15.0
|
1.0
|
N
|
G:TRP305
|
4.3
|
13.7
|
1.0
|
CA
|
H:VAL304
|
4.4
|
18.6
|
1.0
|
N
|
H:GLY306
|
4.5
|
17.2
|
1.0
|
CA
|
G:VAL304
|
4.5
|
11.9
|
1.0
|
N
|
G:GLY306
|
4.5
|
13.8
|
1.0
|
CB
|
H:VAL304
|
4.6
|
17.8
|
1.0
|
N
|
H:VAL304
|
4.6
|
15.8
|
1.0
|
CB
|
G:VAL304
|
4.6
|
16.7
|
1.0
|
N
|
G:VAL304
|
4.7
|
13.2
|
1.0
|
O
|
H:HOH1096
|
4.7
|
24.7
|
1.0
|
CD1
|
H:TRP305
|
4.7
|
14.4
|
1.0
|
CD1
|
G:TRP305
|
4.7
|
15.3
|
1.0
|
CD1
|
H:PHE314
|
4.8
|
16.6
|
1.0
|
O
|
G:HOH1152
|
4.8
|
23.9
|
1.0
|
C
|
H:TRP305
|
4.9
|
21.3
|
1.0
|
CD1
|
G:PHE314
|
4.9
|
15.2
|
1.0
|
C
|
G:TRP305
|
4.9
|
15.0
|
1.0
|
CG
|
H:PHE314
|
4.9
|
19.9
|
1.0
|
|
Reference:
Ssgcid,
J.Y.Yano,
D.Lorimer,
T.E.Edwards.
Tbd To Be Published.
Page generated: Mon Oct 7 21:58:39 2024
|