Sodium in PDB 3ihv: Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution
Protein crystallography data
The structure of Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution, PDB code: 3ihv
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)
|
29.75 /
1.70
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
62.908,
72.318,
131.629,
90.00,
97.31,
90.00
|
R / Rfree (%)
|
16.2 /
19.3
|
Other elements in 3ihv:
The structure of Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution also contains other interesting chemical elements:
Sodium Binding Sites:
The binding sites of Sodium atom in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution
(pdb code 3ihv). 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 Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution, PDB code: 3ihv:
Jump to Sodium binding site number:
1;
2;
3;
4;
Sodium binding site 1 out
of 4 in 3ihv
Go back to
Sodium Binding Sites List in 3ihv
Sodium binding site 1 out
of 4 in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution
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 Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na5
b:25.8
occ:1.00
|
O
|
A:HOH572
|
2.1
|
24.2
|
1.0
|
O
|
A:TRP516
|
2.3
|
9.5
|
1.0
|
O
|
A:GLY513
|
2.4
|
5.2
|
1.0
|
O
|
A:HOH901
|
2.5
|
10.4
|
1.0
|
O
|
A:TYR514
|
2.9
|
6.7
|
1.0
|
C
|
A:TYR514
|
3.4
|
6.9
|
1.0
|
C
|
A:TRP516
|
3.5
|
10.3
|
1.0
|
C
|
A:GLY513
|
3.6
|
5.7
|
1.0
|
CA
|
A:TYR514
|
3.7
|
6.8
|
1.0
|
N
|
A:TRP516
|
4.0
|
6.9
|
1.0
|
N
|
A:TYR514
|
4.1
|
5.6
|
1.0
|
CA
|
A:TRP516
|
4.2
|
8.4
|
1.0
|
C
|
A:TRP515
|
4.3
|
6.2
|
1.0
|
N
|
A:TRP515
|
4.4
|
6.5
|
1.0
|
N
|
A:GLU517
|
4.5
|
11.5
|
1.0
|
CB
|
A:TRP516
|
4.6
|
9.1
|
1.0
|
CA
|
A:GLU517
|
4.7
|
13.7
|
1.0
|
O
|
A:TRP515
|
4.7
|
4.8
|
1.0
|
CA
|
A:GLY513
|
4.8
|
5.9
|
1.0
|
CA
|
A:TRP515
|
4.9
|
6.4
|
1.0
|
|
Sodium binding site 2 out
of 4 in 3ihv
Go back to
Sodium Binding Sites List in 3ihv
Sodium binding site 2 out
of 4 in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution
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 Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na7
b:16.9
occ:1.00
|
O
|
A:PHE287
|
2.2
|
11.4
|
1.0
|
O
|
A:ASN411
|
2.3
|
7.9
|
1.0
|
O
|
A:HOH811
|
2.3
|
7.8
|
1.0
|
O
|
A:HOH726
|
2.4
|
7.7
|
1.0
|
OD1
|
A:ASN413
|
2.5
|
9.3
|
1.0
|
O
|
A:HOH685
|
2.8
|
14.5
|
1.0
|
CG
|
A:ASN413
|
3.3
|
8.1
|
1.0
|
C
|
A:PHE287
|
3.4
|
10.7
|
1.0
|
C
|
A:ASN411
|
3.4
|
7.4
|
1.0
|
ND2
|
A:ASN413
|
3.5
|
7.4
|
1.0
|
N
|
A:PHE287
|
3.9
|
8.7
|
1.0
|
CA
|
A:GLY274
|
4.0
|
12.2
|
1.0
|
CB
|
A:ASN411
|
4.0
|
7.9
|
1.0
|
CA
|
A:ASN411
|
4.1
|
7.2
|
1.0
|
CB
|
A:TYR288
|
4.2
|
13.3
|
1.0
|
CA
|
A:PHE287
|
4.2
|
8.5
|
1.0
|
N
|
A:GLY274
|
4.3
|
12.0
|
1.0
|
OG
|
A:SER286
|
4.3
|
9.4
|
1.0
|
N
|
A:TYR288
|
4.4
|
12.0
|
1.0
|
N
|
A:ASN413
|
4.4
|
6.4
|
1.0
|
O
|
A:HOH1057
|
4.4
|
36.6
|
1.0
|
N
|
A:VAL412
|
4.5
|
7.1
|
1.0
|
CA
|
A:TYR288
|
4.5
|
12.1
|
1.0
|
C
|
A:VAL412
|
4.5
|
6.9
|
1.0
|
CB
|
A:ASN413
|
4.6
|
7.2
|
1.0
|
O
|
A:HOH904
|
4.6
|
13.9
|
1.0
|
CB
|
A:PHE287
|
4.7
|
7.8
|
1.0
|
CA
|
A:VAL412
|
4.7
|
6.7
|
1.0
|
O
|
A:HOH1121
|
4.7
|
19.9
|
1.0
|
CA
|
A:ASN413
|
4.8
|
7.1
|
1.0
|
C
|
A:SER286
|
4.8
|
8.8
|
1.0
|
O
|
A:THR271
|
4.9
|
7.8
|
1.0
|
CD1
|
A:TYR288
|
5.0
|
15.5
|
1.0
|
|
Sodium binding site 3 out
of 4 in 3ihv
Go back to
Sodium Binding Sites List in 3ihv
Sodium binding site 3 out
of 4 in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution
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 Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na6
b:17.2
occ:1.00
|
O
|
B:PHE287
|
2.2
|
12.0
|
1.0
|
O
|
B:ASN411
|
2.3
|
8.7
|
1.0
|
OD1
|
B:ASN413
|
2.4
|
5.0
|
1.0
|
O
|
B:HOH662
|
2.5
|
7.9
|
1.0
|
O
|
B:HOH905
|
2.5
|
11.7
|
1.0
|
O
|
B:HOH714
|
2.8
|
17.9
|
1.0
|
CG
|
B:ASN413
|
3.2
|
7.1
|
1.0
|
C
|
B:PHE287
|
3.4
|
11.1
|
1.0
|
C
|
B:ASN411
|
3.4
|
7.5
|
1.0
|
ND2
|
B:ASN413
|
3.5
|
8.0
|
1.0
|
N
|
B:PHE287
|
3.9
|
8.0
|
1.0
|
CA
|
B:GLY274
|
4.0
|
12.3
|
1.0
|
CB
|
B:ASN411
|
4.1
|
7.6
|
1.0
|
CA
|
B:ASN411
|
4.1
|
7.0
|
1.0
|
CA
|
B:PHE287
|
4.2
|
9.2
|
1.0
|
N
|
B:ASN413
|
4.3
|
7.2
|
1.0
|
CB
|
B:TYR288
|
4.3
|
13.6
|
1.0
|
N
|
B:GLY274
|
4.4
|
12.6
|
1.0
|
OG
|
B:SER286
|
4.4
|
9.1
|
1.0
|
N
|
B:TYR288
|
4.4
|
11.8
|
1.0
|
N
|
B:VAL412
|
4.4
|
6.4
|
1.0
|
C
|
B:VAL412
|
4.5
|
7.2
|
1.0
|
CB
|
B:ASN413
|
4.5
|
6.5
|
1.0
|
CA
|
B:TYR288
|
4.6
|
12.9
|
1.0
|
CB
|
B:PHE287
|
4.6
|
8.6
|
1.0
|
CA
|
B:VAL412
|
4.6
|
7.3
|
1.0
|
CA
|
B:ASN413
|
4.8
|
6.6
|
1.0
|
C
|
B:SER286
|
4.8
|
8.8
|
1.0
|
O
|
B:HOH880
|
4.8
|
15.3
|
1.0
|
O
|
B:HOH605
|
4.8
|
20.8
|
1.0
|
O
|
B:THR271
|
4.9
|
10.2
|
1.0
|
CA
|
B:SER286
|
5.0
|
8.4
|
1.0
|
O
|
B:VAL412
|
5.0
|
6.8
|
1.0
|
|
Sodium binding site 4 out
of 4 in 3ihv
Go back to
Sodium Binding Sites List in 3ihv
Sodium binding site 4 out
of 4 in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution
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 Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na8
b:30.2
occ:1.00
|
O
|
B:HOH892
|
2.2
|
23.7
|
1.0
|
O
|
B:TRP516
|
2.4
|
8.2
|
1.0
|
O
|
B:GLY513
|
2.4
|
6.7
|
1.0
|
O
|
B:HOH916
|
2.4
|
12.9
|
1.0
|
O
|
B:TYR514
|
2.9
|
8.8
|
1.0
|
C
|
B:TYR514
|
3.4
|
8.3
|
1.0
|
C
|
B:TRP516
|
3.6
|
9.6
|
1.0
|
C
|
B:GLY513
|
3.6
|
7.2
|
1.0
|
CA
|
B:TYR514
|
3.7
|
8.2
|
1.0
|
N
|
B:TRP516
|
4.0
|
7.9
|
1.0
|
N
|
B:TYR514
|
4.1
|
7.4
|
1.0
|
CA
|
B:TRP516
|
4.3
|
8.2
|
1.0
|
N
|
B:TRP515
|
4.4
|
7.6
|
1.0
|
C
|
B:TRP515
|
4.4
|
7.7
|
1.0
|
O
|
B:HOH636
|
4.6
|
32.0
|
1.0
|
N
|
B:GLU517
|
4.6
|
10.6
|
1.0
|
CB
|
B:TRP516
|
4.7
|
8.6
|
1.0
|
O
|
B:TRP515
|
4.7
|
7.2
|
1.0
|
CA
|
B:GLU517
|
4.8
|
12.2
|
1.0
|
CA
|
B:GLY513
|
4.8
|
7.0
|
1.0
|
CA
|
B:TRP515
|
4.9
|
7.1
|
1.0
|
|
Reference:
Joint Center For Structural Genomics (Jcsg),
Joint Center For Structural Genomics (Jcsg).
N/A N/A.
Page generated: Mon Oct 7 10:57:31 2024
|