Calcium in PDB 6tit: Vsv G_440
Protein crystallography data
The structure of Vsv G_440, PDB code: 6tit
was solved by
A.A.Albertini,
L.Belot,
A.Abouhamdan,
Y.Gaudin,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
44.82 /
2.07
|
Space group
|
P 6 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
120.950,
120.950,
200.320,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
20.7 /
24.2
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Vsv G_440
(pdb code 6tit). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 4 binding sites of Calcium where determined in the
Vsv G_440, PDB code: 6tit:
Jump to Calcium binding site number:
1;
2;
3;
4;
Calcium binding site 1 out
of 4 in 6tit
Go back to
Calcium Binding Sites List in 6tit
Calcium binding site 1 out
of 4 in the Vsv G_440
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Vsv G_440 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca510
b:74.2
occ:1.00
|
OG
|
A:SER190
|
2.2
|
54.4
|
1.0
|
H
|
A:SER190
|
2.9
|
59.3
|
1.0
|
O
|
A:ILE37
|
3.0
|
53.0
|
1.0
|
O
|
A:PHE188
|
3.1
|
46.0
|
1.0
|
N
|
A:SER190
|
3.1
|
49.4
|
1.0
|
HA2
|
A:GLY193
|
3.1
|
54.9
|
1.0
|
HG22
|
A:THR39
|
3.2
|
68.3
|
1.0
|
HD2
|
A:PHE188
|
3.3
|
65.7
|
1.0
|
HA
|
A:PHE189
|
3.3
|
55.5
|
1.0
|
CB
|
A:SER190
|
3.3
|
52.5
|
1.0
|
HG21
|
A:THR39
|
3.4
|
68.3
|
1.0
|
C
|
A:GLY193
|
3.5
|
65.2
|
1.0
|
HB3
|
A:SER190
|
3.6
|
63.0
|
1.0
|
C
|
A:PHE189
|
3.6
|
56.6
|
1.0
|
CD2
|
A:PHE188
|
3.6
|
54.8
|
1.0
|
HE2
|
A:PHE188
|
3.6
|
57.9
|
1.0
|
O
|
A:GLY193
|
3.6
|
56.4
|
1.0
|
CA
|
A:GLY193
|
3.7
|
45.8
|
1.0
|
CA
|
A:SER190
|
3.7
|
56.7
|
1.0
|
CG2
|
A:THR39
|
3.8
|
56.9
|
1.0
|
CE2
|
A:PHE188
|
3.8
|
48.2
|
1.0
|
HA2
|
A:GLY38
|
3.8
|
52.9
|
1.0
|
CA
|
A:PHE189
|
3.8
|
46.2
|
1.0
|
H
|
A:GLY193
|
3.8
|
56.2
|
1.0
|
C
|
A:PHE188
|
3.8
|
45.3
|
1.0
|
N
|
A:GLU194
|
3.9
|
52.0
|
1.0
|
H
|
A:GLU194
|
4.0
|
62.4
|
1.0
|
H
|
A:THR39
|
4.0
|
62.9
|
1.0
|
C
|
A:ILE37
|
4.1
|
50.2
|
1.0
|
HB2
|
A:SER190
|
4.1
|
63.0
|
1.0
|
N
|
A:GLY193
|
4.1
|
46.8
|
1.0
|
N
|
A:PHE189
|
4.1
|
41.8
|
1.0
|
O
|
A:SER190
|
4.2
|
58.2
|
1.0
|
HB
|
A:THR39
|
4.3
|
73.0
|
1.0
|
HB
|
A:ILE37
|
4.3
|
63.4
|
1.0
|
N
|
A:THR39
|
4.3
|
52.4
|
1.0
|
O
|
A:PHE189
|
4.4
|
51.8
|
1.0
|
C
|
A:SER190
|
4.5
|
59.4
|
1.0
|
CG
|
A:PHE188
|
4.5
|
48.3
|
1.0
|
HG22
|
A:ILE37
|
4.5
|
64.8
|
1.0
|
CA
|
A:GLY38
|
4.5
|
44.0
|
1.0
|
HG23
|
A:THR39
|
4.5
|
68.3
|
1.0
|
HA
|
A:SER190
|
4.5
|
68.1
|
1.0
|
O
|
A:GLU194
|
4.5
|
51.4
|
1.0
|
HA3
|
A:GLY193
|
4.5
|
54.9
|
1.0
|
CB
|
A:THR39
|
4.6
|
60.8
|
1.0
|
C
|
A:GLU194
|
4.6
|
62.2
|
1.0
|
C
|
A:GLY38
|
4.6
|
60.6
|
1.0
|
HD23
|
A:LEU195
|
4.7
|
70.2
|
1.0
|
N
|
A:GLY38
|
4.7
|
47.1
|
1.0
|
HB3
|
A:PHE188
|
4.7
|
57.1
|
1.0
|
CZ
|
A:PHE188
|
4.7
|
50.0
|
1.0
|
CA
|
A:GLU194
|
4.8
|
67.3
|
1.0
|
H
|
A:PHE189
|
4.8
|
50.2
|
1.0
|
H
|
A:ASP192
|
4.9
|
82.2
|
1.0
|
H
|
A:ILE37
|
4.9
|
66.2
|
1.0
|
CB
|
A:PHE188
|
5.0
|
47.6
|
1.0
|
N
|
A:LEU195
|
5.0
|
55.1
|
1.0
|
|
Calcium binding site 2 out
of 4 in 6tit
Go back to
Calcium Binding Sites List in 6tit
Calcium binding site 2 out
of 4 in the Vsv G_440
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Vsv G_440 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca511
b:81.6
occ:1.00
|
HZ2
|
A:LYS47
|
2.4
|
92.3
|
1.0
|
HD2
|
A:LYS47
|
2.7
|
77.3
|
1.0
|
HZ3
|
A:LYS50
|
2.9
|
52.9
|
1.0
|
HZ2
|
A:LYS50
|
3.1
|
52.9
|
1.0
|
O
|
A:HOH801
|
3.1
|
62.3
|
1.0
|
HG3
|
A:LYS47
|
3.2
|
75.2
|
1.0
|
NZ
|
A:LYS47
|
3.2
|
76.9
|
1.0
|
NZ
|
A:LYS50
|
3.4
|
44.1
|
1.0
|
CD
|
A:LYS47
|
3.4
|
64.4
|
1.0
|
HZ3
|
A:LYS47
|
3.4
|
92.3
|
1.0
|
HZ1
|
A:LYS50
|
3.6
|
52.9
|
1.0
|
CZ
|
A:TYR209
|
3.7
|
49.0
|
1.0
|
OH
|
A:TYR209
|
3.7
|
54.9
|
1.0
|
CE1
|
A:TYR209
|
3.7
|
43.6
|
1.0
|
HE1
|
A:TYR209
|
3.7
|
52.3
|
1.0
|
CE
|
A:LYS47
|
3.8
|
72.0
|
1.0
|
CG
|
A:LYS47
|
3.8
|
62.6
|
1.0
|
HZ1
|
A:LYS47
|
3.8
|
92.3
|
1.0
|
HE1
|
A:HIS8
|
3.9
|
79.7
|
1.0
|
HE3
|
A:LYS47
|
4.0
|
86.5
|
1.0
|
O3
|
A:GOL506
|
4.1
|
44.6
|
1.0
|
HH
|
A:TYR209
|
4.2
|
65.9
|
1.0
|
HD3
|
A:LYS47
|
4.2
|
77.3
|
1.0
|
CE2
|
A:TYR209
|
4.3
|
40.9
|
1.0
|
HE2
|
A:MET184
|
4.3
|
59.2
|
1.0
|
HE1
|
A:MET184
|
4.4
|
59.2
|
1.0
|
HG2
|
A:LYS47
|
4.4
|
75.2
|
1.0
|
CD1
|
A:TYR209
|
4.4
|
42.2
|
1.0
|
HD3
|
A:LYS50
|
4.6
|
63.9
|
1.0
|
HB2
|
A:LYS47
|
4.6
|
63.5
|
1.0
|
H32
|
A:GOL506
|
4.6
|
63.6
|
1.0
|
HE2
|
A:TYR209
|
4.6
|
49.1
|
1.0
|
HE2
|
A:LYS47
|
4.6
|
86.5
|
1.0
|
HO3
|
A:GOL506
|
4.7
|
53.6
|
1.0
|
CE
|
A:LYS50
|
4.7
|
49.5
|
1.0
|
CE
|
A:MET184
|
4.8
|
49.3
|
1.0
|
O
|
A:HOH709
|
4.8
|
64.2
|
1.0
|
CE1
|
A:HIS8
|
4.8
|
66.4
|
1.0
|
HD1
|
A:TYR209
|
4.8
|
50.7
|
1.0
|
CB
|
A:LYS47
|
4.9
|
52.9
|
1.0
|
C3
|
A:GOL506
|
4.9
|
53.0
|
1.0
|
CD2
|
A:TYR209
|
4.9
|
40.7
|
1.0
|
CG
|
A:TYR209
|
5.0
|
41.9
|
1.0
|
|
Calcium binding site 3 out
of 4 in 6tit
Go back to
Calcium Binding Sites List in 6tit
Calcium binding site 3 out
of 4 in the Vsv G_440
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Vsv G_440 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca512
b:0.2
occ:1.00
|
O
|
A:HOH772
|
3.1
|
54.3
|
1.0
|
HG2
|
A:GLU286
|
3.1
|
57.0
|
1.0
|
O
|
A:HOH806
|
3.9
|
63.9
|
0.3
|
CG
|
A:GLU286
|
4.0
|
47.5
|
1.0
|
O
|
A:HOH808
|
4.2
|
44.0
|
1.0
|
CD
|
A:GLU286
|
4.3
|
57.0
|
1.0
|
HG3
|
A:GLU286
|
4.5
|
57.0
|
1.0
|
OE2
|
A:GLU286
|
4.6
|
56.7
|
1.0
|
HB2
|
A:GLU286
|
4.8
|
43.6
|
1.0
|
OE1
|
A:GLU286
|
4.9
|
56.0
|
1.0
|
|
Calcium binding site 4 out
of 4 in 6tit
Go back to
Calcium Binding Sites List in 6tit
Calcium binding site 4 out
of 4 in the Vsv G_440
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Vsv G_440 within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca513
b:86.0
occ:1.00
|
HZ3
|
A:LYS242
|
2.5
|
71.0
|
1.0
|
H
|
A:MET239
|
2.5
|
48.1
|
1.0
|
HG3
|
A:GLU238
|
3.0
|
58.3
|
1.0
|
HA2
|
A:GLY228
|
3.0
|
50.3
|
1.0
|
HB2
|
A:MET239
|
3.0
|
58.7
|
1.0
|
O
|
A:TRP227
|
3.1
|
43.1
|
1.0
|
NZ
|
A:LYS242
|
3.1
|
59.1
|
1.0
|
HZ1
|
A:LYS242
|
3.1
|
71.0
|
1.0
|
CD2
|
A:PHE245
|
3.1
|
43.9
|
1.0
|
N
|
A:MET239
|
3.2
|
40.1
|
1.0
|
CG
|
A:PHE245
|
3.2
|
44.8
|
1.0
|
HD2
|
A:PHE245
|
3.3
|
52.7
|
1.0
|
HD2
|
A:LYS242
|
3.4
|
77.3
|
1.0
|
HA
|
A:GLU238
|
3.4
|
49.5
|
1.0
|
HE2
|
A:LYS242
|
3.5
|
85.8
|
1.0
|
CE2
|
A:PHE245
|
3.5
|
39.1
|
1.0
|
HB2
|
A:PHE245
|
3.5
|
52.3
|
1.0
|
HG2
|
A:GLU238
|
3.5
|
58.3
|
1.0
|
CE
|
A:LYS242
|
3.6
|
71.5
|
1.0
|
O
|
A:MET239
|
3.6
|
48.2
|
1.0
|
CD1
|
A:PHE245
|
3.6
|
38.8
|
1.0
|
CG
|
A:GLU238
|
3.7
|
48.5
|
1.0
|
HD3
|
A:LYS242
|
3.7
|
77.3
|
1.0
|
CD
|
A:LYS242
|
3.8
|
64.4
|
1.0
|
CB
|
A:PHE245
|
3.8
|
43.5
|
1.0
|
CZ
|
A:PHE245
|
3.8
|
42.4
|
1.0
|
CB
|
A:MET239
|
3.9
|
48.9
|
1.0
|
HZ2
|
A:LYS242
|
3.9
|
71.0
|
1.0
|
HE2
|
A:PHE245
|
3.9
|
47.0
|
1.0
|
C
|
A:TRP227
|
3.9
|
39.9
|
1.0
|
CA
|
A:GLY228
|
3.9
|
41.9
|
1.0
|
CE1
|
A:PHE245
|
3.9
|
44.6
|
1.0
|
CA
|
A:MET239
|
3.9
|
47.7
|
1.0
|
HB3
|
A:PHE245
|
4.0
|
52.3
|
1.0
|
C
|
A:GLU238
|
4.1
|
43.6
|
1.0
|
CA
|
A:GLU238
|
4.1
|
41.2
|
1.0
|
HD1
|
A:PHE245
|
4.1
|
46.5
|
1.0
|
C
|
A:MET239
|
4.2
|
49.5
|
1.0
|
N
|
A:GLY228
|
4.3
|
45.9
|
1.0
|
HG3
|
A:MET239
|
4.3
|
47.7
|
1.0
|
HA3
|
A:GLY228
|
4.4
|
50.3
|
1.0
|
HZ
|
A:PHE245
|
4.4
|
50.9
|
1.0
|
CB
|
A:GLU238
|
4.4
|
43.4
|
1.0
|
HB3
|
A:MET239
|
4.5
|
58.7
|
1.0
|
HA
|
A:LYS242
|
4.6
|
52.7
|
1.0
|
HE1
|
A:PHE245
|
4.6
|
53.5
|
1.0
|
HE3
|
A:LYS242
|
4.6
|
85.8
|
1.0
|
CG
|
A:MET239
|
4.6
|
39.7
|
1.0
|
HG23
|
A:VAL229
|
4.7
|
48.2
|
1.0
|
HB3
|
A:TRP227
|
4.8
|
52.0
|
1.0
|
HB2
|
A:GLU238
|
4.8
|
52.1
|
1.0
|
CD
|
A:GLU238
|
4.8
|
56.4
|
1.0
|
HB2
|
A:TRP227
|
4.8
|
52.0
|
1.0
|
HA
|
A:MET239
|
4.9
|
57.2
|
1.0
|
C
|
A:GLY228
|
4.9
|
38.0
|
1.0
|
OE1
|
A:GLU238
|
4.9
|
63.4
|
1.0
|
|
Reference:
A.A.Albertini,
L.Belot,
A.Abouhamdan,
Y.Gaudin.
Vsv G_440 To Be Published.
Page generated: Tue Jul 16 15:18:23 2024
|