Sodium in PDB 4adi: Crystal Structure of the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I)
Protein crystallography data
The structure of Crystal Structure of the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I), PDB code: 4adi
was solved by
R.M.Dubois,
M.C.Vaney,
M.A.Tortorici,
R.Al Kurdi,
G.Barba-Spaeth,
F.A.Rey,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
20.00 /
1.80
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
129.980,
121.380,
126.430,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
16.66 /
18.31
|
Sodium Binding Sites:
The binding sites of Sodium atom in the Crystal Structure of the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I)
(pdb code 4adi). This binding sites where shown within
5.0 Angstroms radius around Sodium atom.
In total 3 binding sites of Sodium where determined in the
Crystal Structure of the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I), PDB code: 4adi:
Jump to Sodium binding site number:
1;
2;
3;
Sodium binding site 1 out
of 3 in 4adi
Go back to
Sodium Binding Sites List in 4adi
Sodium binding site 1 out
of 3 in the Crystal Structure of the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I)
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 the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Na1442
b:31.9
occ:1.00
|
O
|
A:ALA89
|
2.2
|
23.3
|
1.0
|
OD2
|
A:ASP136
|
2.2
|
50.4
|
1.0
|
OD1
|
A:ASN88
|
2.3
|
29.2
|
1.0
|
O
|
A:THR137
|
2.4
|
27.5
|
1.0
|
O
|
A:HOH2174
|
2.5
|
37.0
|
1.0
|
CG
|
A:ASN88
|
3.2
|
37.0
|
1.0
|
CG
|
A:ASP136
|
3.3
|
50.8
|
1.0
|
C
|
A:ALA89
|
3.5
|
24.7
|
1.0
|
C
|
A:THR137
|
3.6
|
28.7
|
1.0
|
CB
|
A:ASP136
|
3.8
|
38.7
|
1.0
|
ND2
|
A:ASN88
|
3.9
|
27.4
|
1.0
|
C
|
A:ASN88
|
4.0
|
23.4
|
1.0
|
N
|
A:ALA89
|
4.0
|
21.0
|
1.0
|
CB
|
A:ASN88
|
4.1
|
20.1
|
1.0
|
O
|
A:ASN88
|
4.2
|
22.3
|
1.0
|
N
|
A:SER91
|
4.2
|
25.0
|
1.0
|
CG2
|
A:VAL138
|
4.2
|
27.5
|
1.0
|
N
|
A:THR137
|
4.3
|
29.9
|
1.0
|
CA
|
A:ALA89
|
4.4
|
21.2
|
1.0
|
N
|
A:TYR90
|
4.4
|
22.1
|
1.0
|
N
|
A:VAL138
|
4.4
|
24.0
|
1.0
|
CA
|
A:VAL138
|
4.4
|
23.1
|
1.0
|
C
|
A:ASP136
|
4.4
|
35.7
|
1.0
|
C
|
A:TYR90
|
4.4
|
27.2
|
1.0
|
OD1
|
A:ASP136
|
4.4
|
58.9
|
1.0
|
O
|
A:HOH2073
|
4.4
|
48.5
|
1.0
|
CA
|
A:TYR90
|
4.5
|
22.1
|
1.0
|
CA
|
A:ASN88
|
4.5
|
19.9
|
1.0
|
O
|
A:ACT1443
|
4.5
|
59.4
|
1.0
|
O
|
A:HOH2173
|
4.6
|
29.0
|
1.0
|
CA
|
A:THR137
|
4.6
|
28.2
|
1.0
|
O
|
A:ASP136
|
4.7
|
34.9
|
1.0
|
CB
|
A:SER91
|
4.7
|
28.1
|
1.0
|
CA
|
A:ASP136
|
4.7
|
36.4
|
1.0
|
CA
|
A:SER91
|
4.9
|
25.1
|
1.0
|
CB
|
A:VAL138
|
4.9
|
27.4
|
1.0
|
|
Sodium binding site 2 out
of 3 in 4adi
Go back to
Sodium Binding Sites List in 4adi
Sodium binding site 2 out
of 3 in the Crystal Structure of the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I)
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 the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Na1439
b:30.0
occ:1.00
|
OD2
|
B:ASP136
|
2.2
|
47.5
|
1.0
|
O
|
B:ALA89
|
2.2
|
24.1
|
1.0
|
OD1
|
B:ASN88
|
2.3
|
30.1
|
1.0
|
O
|
B:THR137
|
2.4
|
29.6
|
1.0
|
O
|
B:HOH2132
|
2.5
|
41.3
|
1.0
|
CG
|
B:ASN88
|
3.2
|
37.4
|
1.0
|
CG
|
B:ASP136
|
3.3
|
48.7
|
1.0
|
C
|
B:ALA89
|
3.5
|
25.0
|
1.0
|
C
|
B:THR137
|
3.6
|
30.9
|
1.0
|
CB
|
B:ASP136
|
3.8
|
38.9
|
1.0
|
ND2
|
B:ASN88
|
3.9
|
29.7
|
1.0
|
C
|
B:ASN88
|
4.0
|
23.8
|
1.0
|
O
|
B:HOH2138
|
4.0
|
39.7
|
1.0
|
N
|
B:ALA89
|
4.1
|
21.4
|
1.0
|
CB
|
B:ASN88
|
4.1
|
20.5
|
1.0
|
O
|
B:ASN88
|
4.2
|
22.9
|
1.0
|
N
|
B:SER91
|
4.2
|
23.9
|
1.0
|
CG2
|
B:VAL138
|
4.2
|
29.6
|
1.0
|
N
|
B:THR137
|
4.3
|
32.1
|
1.0
|
CA
|
B:ALA89
|
4.4
|
21.6
|
1.0
|
N
|
B:TYR90
|
4.4
|
21.4
|
1.0
|
N
|
B:VAL138
|
4.4
|
25.4
|
1.0
|
C
|
B:ASP136
|
4.4
|
37.4
|
1.0
|
CA
|
B:VAL138
|
4.4
|
24.5
|
1.0
|
C
|
B:TYR90
|
4.4
|
25.4
|
1.0
|
OD1
|
B:ASP136
|
4.4
|
55.3
|
1.0
|
CA
|
B:TYR90
|
4.5
|
21.6
|
1.0
|
CA
|
B:ASN88
|
4.5
|
19.8
|
1.0
|
O
|
B:HOH2131
|
4.6
|
29.2
|
1.0
|
O
|
B:HOH2047
|
4.6
|
44.5
|
1.0
|
CA
|
B:THR137
|
4.6
|
30.6
|
1.0
|
O
|
B:ASP136
|
4.7
|
36.5
|
1.0
|
CB
|
B:SER91
|
4.7
|
27.8
|
1.0
|
CA
|
B:ASP136
|
4.8
|
37.2
|
1.0
|
CA
|
B:SER91
|
4.9
|
24.3
|
1.0
|
CB
|
B:VAL138
|
4.9
|
29.3
|
1.0
|
O
|
B:HOH2134
|
5.0
|
43.2
|
1.0
|
|
Sodium binding site 3 out
of 3 in 4adi
Go back to
Sodium Binding Sites List in 4adi
Sodium binding site 3 out
of 3 in the Crystal Structure of the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I)
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 the Rubella Virus Envelope Glycoprotein E1 in Post-Fusion Form (Crystal Form I) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Na1443
b:32.2
occ:1.00
|
OD2
|
C:ASP136
|
2.2
|
53.2
|
1.0
|
O
|
C:ALA89
|
2.2
|
22.7
|
1.0
|
O
|
C:HOH2127
|
2.3
|
40.7
|
1.0
|
OD1
|
C:ASN88
|
2.3
|
30.4
|
1.0
|
O
|
C:THR137
|
2.5
|
27.7
|
1.0
|
CG
|
C:ASN88
|
3.2
|
37.0
|
1.0
|
CG
|
C:ASP136
|
3.3
|
49.7
|
1.0
|
C
|
C:ALA89
|
3.5
|
23.6
|
1.0
|
C
|
C:THR137
|
3.6
|
29.0
|
1.0
|
CB
|
C:ASP136
|
3.8
|
39.3
|
1.0
|
ND2
|
C:ASN88
|
3.8
|
29.9
|
1.0
|
C
|
C:ASN88
|
4.0
|
22.2
|
1.0
|
N
|
C:ALA89
|
4.1
|
20.0
|
1.0
|
CB
|
C:ASN88
|
4.1
|
19.4
|
1.0
|
N
|
C:SER91
|
4.2
|
23.5
|
1.0
|
CG2
|
C:VAL138
|
4.2
|
25.2
|
1.0
|
O
|
C:ASN88
|
4.2
|
21.1
|
1.0
|
N
|
C:THR137
|
4.3
|
31.4
|
1.0
|
CA
|
C:ALA89
|
4.4
|
19.9
|
1.0
|
C
|
C:TYR90
|
4.4
|
25.5
|
1.0
|
N
|
C:TYR90
|
4.4
|
20.3
|
1.0
|
OD1
|
C:ASP136
|
4.4
|
51.1
|
1.0
|
C
|
C:ASP136
|
4.4
|
37.1
|
1.0
|
O
|
C:ACT1444
|
4.4
|
56.5
|
1.0
|
CA
|
C:TYR90
|
4.4
|
20.5
|
1.0
|
N
|
C:VAL138
|
4.5
|
23.0
|
1.0
|
CA
|
C:VAL138
|
4.5
|
21.4
|
1.0
|
CA
|
C:ASN88
|
4.5
|
18.6
|
1.0
|
O
|
C:HOH2044
|
4.6
|
43.6
|
1.0
|
O
|
C:HOH2126
|
4.6
|
27.9
|
1.0
|
CA
|
C:THR137
|
4.6
|
29.9
|
1.0
|
CB
|
C:SER91
|
4.7
|
27.7
|
1.0
|
O
|
C:ASP136
|
4.8
|
36.0
|
1.0
|
CA
|
C:ASP136
|
4.8
|
37.3
|
1.0
|
CA
|
C:SER91
|
4.8
|
24.0
|
1.0
|
O
|
C:HOH2128
|
4.9
|
45.9
|
1.0
|
CB
|
C:VAL138
|
4.9
|
25.4
|
1.0
|
|
Reference:
R.M.Dubois,
M.C.Vaney,
M.A.Tortorici,
R.A.Kurdi,
G.Barba-Spaeth,
T.Krey,
F.A.Rey.
Functional and Evolutionary Insight From the Crystal Structure of Rubella Virus Protein E1. Nature V. 493 552 2013.
ISSN: ISSN 0028-0836
PubMed: 23292515
DOI: 10.1038/NATURE11741
Page generated: Mon Oct 7 14:19:54 2024
|