Cobalt in PDB 3gog: Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Protein crystallography data
The structure of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine, PDB code: 3gog
was solved by
S.D.Gilbert,
R.T.Batey,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
19.97 /
2.10
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
132.510,
35.120,
41.760,
90.00,
90.57,
90.00
|
R / Rfree (%)
|
22 /
25.6
|
Other elements in 3gog:
The structure of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine also contains other interesting chemical elements:
Cobalt Binding Sites:
The binding sites of Cobalt atom in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
(pdb code 3gog). This binding sites where shown within
5.0 Angstroms radius around Cobalt atom.
In total 8 binding sites of Cobalt where determined in the
Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine, PDB code: 3gog:
Jump to Cobalt binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Cobalt binding site 1 out
of 8 in 3gog
Go back to
Cobalt Binding Sites List in 3gog
Cobalt binding site 1 out
of 8 in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 1 of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co101
b:33.0
occ:1.00
|
CO
|
A:NCO101
|
0.0
|
33.0
|
1.0
|
N2
|
A:NCO101
|
2.0
|
29.7
|
1.0
|
N1
|
A:NCO101
|
2.0
|
29.5
|
1.0
|
N3
|
A:NCO101
|
2.0
|
29.5
|
1.0
|
N4
|
A:NCO101
|
2.0
|
30.7
|
1.0
|
N5
|
A:NCO101
|
2.0
|
30.1
|
1.0
|
N6
|
A:NCO101
|
2.0
|
30.9
|
1.0
|
O
|
A:HOH322
|
3.7
|
33.9
|
1.0
|
O
|
A:HOH435
|
3.8
|
42.3
|
1.0
|
OP1
|
A:U67
|
3.9
|
25.2
|
1.0
|
O
|
A:HOH358
|
4.0
|
29.3
|
1.0
|
O3'
|
A:A66
|
4.2
|
24.6
|
1.0
|
O
|
A:HOH315
|
4.4
|
35.3
|
1.0
|
O
|
A:HOH349
|
4.5
|
71.2
|
1.0
|
P
|
A:U67
|
4.7
|
25.3
|
1.0
|
O2'
|
A:A66
|
5.0
|
29.4
|
1.0
|
|
Cobalt binding site 2 out
of 8 in 3gog
Go back to
Cobalt Binding Sites List in 3gog
Cobalt binding site 2 out
of 8 in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 2 of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co102
b:67.1
occ:1.00
|
CO
|
A:NCO102
|
0.0
|
67.1
|
1.0
|
N2
|
A:NCO102
|
2.0
|
66.6
|
1.0
|
N4
|
A:NCO102
|
2.0
|
66.5
|
1.0
|
N3
|
A:NCO102
|
2.0
|
66.4
|
1.0
|
N6
|
A:NCO102
|
2.0
|
66.3
|
1.0
|
N1
|
A:NCO102
|
2.0
|
66.4
|
1.0
|
N5
|
A:NCO102
|
2.0
|
66.4
|
1.0
|
O
|
A:HOH312
|
3.6
|
33.4
|
1.0
|
O
|
A:HOH428
|
3.6
|
42.3
|
1.0
|
OP1
|
A:G56
|
3.7
|
37.6
|
1.0
|
O
|
A:HOH464
|
3.8
|
47.9
|
1.0
|
OP1
|
A:G38
|
3.8
|
26.0
|
1.0
|
O
|
A:HOH530
|
4.0
|
43.4
|
1.0
|
O
|
A:HOH381
|
4.7
|
34.5
|
1.0
|
P
|
A:G56
|
4.8
|
36.6
|
1.0
|
OP2
|
A:G56
|
4.8
|
36.5
|
1.0
|
C5'
|
A:C39
|
4.9
|
30.4
|
1.0
|
P
|
A:G38
|
5.0
|
27.9
|
1.0
|
|
Cobalt binding site 3 out
of 8 in 3gog
Go back to
Cobalt Binding Sites List in 3gog
Cobalt binding site 3 out
of 8 in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 3 of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co103
b:37.8
occ:1.00
|
CO
|
A:NCO103
|
0.0
|
37.8
|
1.0
|
N3
|
A:NCO103
|
2.0
|
35.5
|
1.0
|
N4
|
A:NCO103
|
2.0
|
37.7
|
1.0
|
N6
|
A:NCO103
|
2.0
|
36.6
|
1.0
|
N1
|
A:NCO103
|
2.0
|
36.1
|
1.0
|
N5
|
A:NCO103
|
2.0
|
35.7
|
1.0
|
N2
|
A:NCO103
|
2.0
|
36.0
|
1.0
|
O
|
A:HOH341
|
3.4
|
32.2
|
1.0
|
O4
|
A:U69
|
3.7
|
25.1
|
1.0
|
O
|
A:HOH415
|
3.8
|
46.5
|
1.0
|
O6
|
A:G56
|
3.9
|
31.7
|
1.0
|
O
|
A:HOH307
|
4.0
|
24.4
|
1.0
|
O
|
A:HOH481
|
4.0
|
46.7
|
1.0
|
O
|
A:HOH348
|
4.2
|
27.3
|
1.0
|
O
|
A:HOH371
|
4.2
|
48.4
|
1.0
|
N7
|
A:G56
|
4.4
|
31.5
|
1.0
|
OP2
|
A:C39
|
4.4
|
29.8
|
1.0
|
O6
|
A:G68
|
4.5
|
25.1
|
1.0
|
C6
|
A:G56
|
4.7
|
32.1
|
1.0
|
OP1
|
A:C39
|
4.9
|
30.0
|
1.0
|
C5
|
A:G56
|
4.9
|
31.3
|
1.0
|
C4
|
A:U69
|
4.9
|
27.1
|
1.0
|
O6
|
A:G57
|
5.0
|
27.9
|
1.0
|
|
Cobalt binding site 4 out
of 8 in 3gog
Go back to
Cobalt Binding Sites List in 3gog
Cobalt binding site 4 out
of 8 in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 4 of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co104
b:31.2
occ:1.00
|
CO
|
A:NCO104
|
0.0
|
31.2
|
1.0
|
N6
|
A:NCO104
|
2.0
|
28.6
|
1.0
|
N3
|
A:NCO104
|
2.0
|
28.2
|
1.0
|
N5
|
A:NCO104
|
2.0
|
28.4
|
1.0
|
N4
|
A:NCO104
|
2.0
|
27.5
|
1.0
|
N2
|
A:NCO104
|
2.0
|
28.4
|
1.0
|
N1
|
A:NCO104
|
2.0
|
28.5
|
1.0
|
O
|
A:HOH306
|
3.7
|
25.1
|
1.0
|
O
|
A:HOH334
|
3.8
|
27.5
|
1.0
|
OP2
|
A:A66
|
3.8
|
26.6
|
1.0
|
O6
|
A:G32
|
3.8
|
26.9
|
1.0
|
O
|
A:HOH302
|
4.0
|
26.3
|
1.0
|
O6
|
A:G31
|
4.0
|
27.4
|
1.0
|
O
|
A:HOH469
|
4.2
|
40.9
|
1.0
|
O
|
A:HOH480
|
4.2
|
38.6
|
1.0
|
O
|
A:HOH311
|
4.2
|
33.0
|
1.0
|
N7
|
A:G31
|
4.3
|
27.8
|
1.0
|
O
|
A:HOH329
|
4.4
|
25.6
|
1.0
|
C6
|
A:G31
|
4.8
|
27.9
|
1.0
|
O
|
A:HOH368
|
4.9
|
58.0
|
1.0
|
C6
|
A:G32
|
4.9
|
28.1
|
1.0
|
C5
|
A:G31
|
5.0
|
27.2
|
1.0
|
|
Cobalt binding site 5 out
of 8 in 3gog
Go back to
Cobalt Binding Sites List in 3gog
Cobalt binding site 5 out
of 8 in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 5 of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co105
b:76.1
occ:1.00
|
CO
|
A:NCO105
|
0.0
|
76.1
|
1.0
|
N1
|
A:NCO105
|
2.0
|
75.5
|
1.0
|
N2
|
A:NCO105
|
2.0
|
75.5
|
1.0
|
N4
|
A:NCO105
|
2.0
|
75.7
|
1.0
|
N6
|
A:NCO105
|
2.0
|
75.0
|
1.0
|
N3
|
A:NCO105
|
2.0
|
75.8
|
1.0
|
N5
|
A:NCO105
|
2.0
|
75.5
|
1.0
|
O
|
A:HOH324
|
3.7
|
41.0
|
1.0
|
O
|
A:HOH547
|
3.8
|
66.3
|
1.0
|
O
|
A:HOH408
|
3.9
|
61.1
|
1.0
|
O
|
A:HOH413
|
4.0
|
38.2
|
1.0
|
O6
|
A:G38
|
4.1
|
26.0
|
1.0
|
OP2
|
A:G37
|
4.1
|
26.3
|
1.0
|
O
|
A:HOH365
|
4.1
|
46.5
|
1.0
|
O
|
A:HOH320
|
4.2
|
36.9
|
1.0
|
N7
|
A:G38
|
4.4
|
26.8
|
1.0
|
O
|
A:HOH505
|
4.4
|
53.4
|
1.0
|
O
|
A:HOH444
|
4.4
|
44.8
|
1.0
|
N7
|
A:G37
|
4.5
|
26.4
|
1.0
|
O
|
A:HOH375
|
4.8
|
45.3
|
1.0
|
C6
|
A:G38
|
4.9
|
27.4
|
1.0
|
|
Cobalt binding site 6 out
of 8 in 3gog
Go back to
Cobalt Binding Sites List in 3gog
Cobalt binding site 6 out
of 8 in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 6 of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co107
b:93.1
occ:1.00
|
CO
|
A:NCO107
|
0.0
|
93.1
|
1.0
|
N2
|
A:NCO107
|
2.0
|
92.8
|
1.0
|
N3
|
A:NCO107
|
2.0
|
93.0
|
1.0
|
N4
|
A:NCO107
|
2.0
|
93.0
|
1.0
|
N1
|
A:NCO107
|
2.0
|
92.9
|
1.0
|
N5
|
A:NCO107
|
2.0
|
92.9
|
1.0
|
N6
|
A:NCO107
|
2.0
|
93.0
|
1.0
|
O
|
A:HOH404
|
3.7
|
40.9
|
1.0
|
OP2
|
A:C41
|
4.0
|
26.9
|
1.0
|
OP1
|
A:C54
|
4.0
|
38.3
|
1.0
|
OP1
|
A:C53
|
4.1
|
40.5
|
1.0
|
O
|
A:HOH326
|
4.2
|
50.8
|
1.0
|
O
|
A:HOH335
|
4.4
|
27.7
|
1.0
|
C5'
|
A:C54
|
4.8
|
34.1
|
1.0
|
O
|
A:HOH354
|
4.9
|
33.9
|
1.0
|
P
|
A:C53
|
4.9
|
39.6
|
1.0
|
OP2
|
A:C53
|
4.9
|
40.7
|
1.0
|
O
|
A:HOH467
|
5.0
|
39.7
|
1.0
|
|
Cobalt binding site 7 out
of 8 in 3gog
Go back to
Cobalt Binding Sites List in 3gog
Cobalt binding site 7 out
of 8 in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 7 of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co108
b:72.7
occ:1.00
|
CO
|
A:NCO108
|
0.0
|
72.7
|
1.0
|
N3
|
A:NCO108
|
2.0
|
71.7
|
1.0
|
N4
|
A:NCO108
|
2.0
|
71.8
|
1.0
|
N2
|
A:NCO108
|
2.0
|
71.7
|
1.0
|
N5
|
A:NCO108
|
2.0
|
72.0
|
1.0
|
N6
|
A:NCO108
|
2.0
|
71.9
|
1.0
|
N1
|
A:NCO108
|
2.0
|
71.7
|
1.0
|
O4
|
A:U47
|
3.7
|
40.8
|
1.0
|
O
|
A:HOH384
|
3.7
|
76.2
|
1.0
|
O
|
A:HOH487
|
3.7
|
81.4
|
1.0
|
O6
|
A:G46
|
4.5
|
32.0
|
1.0
|
OP2
|
A:U51
|
4.6
|
46.7
|
1.0
|
C4
|
A:U47
|
4.7
|
40.2
|
1.0
|
OP1
|
A:C50
|
4.8
|
45.5
|
1.0
|
OP2
|
A:C50
|
4.8
|
44.3
|
1.0
|
|
Cobalt binding site 8 out
of 8 in 3gog
Go back to
Cobalt Binding Sites List in 3gog
Cobalt binding site 8 out
of 8 in the Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 8 of Guanine Riboswitch A21G,U75C Mutant Bound to 6-Chloroguanine within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co112
b:59.9
occ:0.64
|
CO
|
A:NCO112
|
0.0
|
59.9
|
0.6
|
N4
|
A:NCO112
|
2.0
|
58.9
|
0.6
|
N6
|
A:NCO112
|
2.0
|
59.1
|
0.6
|
N1
|
A:NCO112
|
2.0
|
58.9
|
0.6
|
N5
|
A:NCO112
|
2.0
|
58.7
|
0.6
|
N3
|
A:NCO112
|
2.0
|
58.9
|
0.6
|
N2
|
A:NCO112
|
2.0
|
58.9
|
0.6
|
O
|
A:HOH366
|
3.9
|
42.0
|
1.0
|
OP1
|
A:G72
|
4.0
|
23.7
|
1.0
|
OP2
|
A:A73
|
4.9
|
35.8
|
1.0
|
|
Reference:
S.D.Gilbert,
F.E.Reyes,
A.L.Edwards,
R.T.Batey.
Adaptive Ligand Binding By the Purine Riboswitch in the Recognition of Guanine and Adenine Analogs Structure V. 17 857 2009.
ISSN: ISSN 0969-2126
PubMed: 19523903
DOI: 10.1016/J.STR.2009.04.009
Page generated: Tue Jul 30 16:04:16 2024
|