Cobalt in PDB 3got: Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Protein crystallography data
The structure of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine., PDB code: 3got
was solved by
S.D.Gilbert,
F.E.Reyes,
R.T.Batey,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
19.98 /
1.95
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
132.455,
35.084,
41.891,
90.00,
90.10,
90.00
|
R / Rfree (%)
|
21.8 /
26.8
|
Other elements in 3got:
The structure of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. also contains other interesting chemical elements:
Cobalt Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
11;
Binding sites:
The binding sites of Cobalt atom in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
(pdb code 3got). This binding sites where shown within
5.0 Angstroms radius around Cobalt atom.
In total 11 binding sites of Cobalt where determined in the
Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine., PDB code: 3got:
Jump to Cobalt binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Cobalt binding site 1 out
of 11 in 3got
Go back to
Cobalt Binding Sites List in 3got
Cobalt binding site 1 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 1 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co101
b:28.6
occ:1.00
|
CO
|
A:NCO101
|
0.0
|
28.6
|
1.0
|
N1
|
A:NCO101
|
1.9
|
23.4
|
1.0
|
N2
|
A:NCO101
|
1.9
|
26.9
|
1.0
|
N3
|
A:NCO101
|
2.0
|
27.2
|
1.0
|
N6
|
A:NCO101
|
2.0
|
25.0
|
1.0
|
N5
|
A:NCO101
|
2.0
|
26.5
|
1.0
|
N4
|
A:NCO101
|
2.0
|
28.2
|
1.0
|
O
|
A:HOH328
|
3.6
|
36.0
|
1.0
|
O
|
A:HOH488
|
3.9
|
40.4
|
1.0
|
O
|
A:HOH332
|
4.1
|
29.0
|
1.0
|
OP1
|
A:U67
|
4.1
|
23.0
|
1.0
|
O3'
|
A:A66
|
4.4
|
21.2
|
1.0
|
P
|
A:U67
|
5.0
|
20.9
|
1.0
|
|
Cobalt binding site 2 out
of 11 in 3got
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Cobalt Binding Sites List in 3got
Cobalt binding site 2 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 2 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co102
b:44.8
occ:1.00
|
CO
|
A:NCO102
|
0.0
|
44.8
|
1.0
|
N3
|
A:NCO102
|
2.0
|
43.2
|
1.0
|
N2
|
A:NCO102
|
2.0
|
45.4
|
1.0
|
N4
|
A:NCO102
|
2.0
|
43.4
|
1.0
|
N6
|
A:NCO102
|
2.0
|
44.6
|
1.0
|
N5
|
A:NCO102
|
2.0
|
44.1
|
1.0
|
N1
|
A:NCO102
|
2.0
|
42.9
|
1.0
|
O
|
A:HOH451
|
3.8
|
38.4
|
1.0
|
O
|
A:HOH310
|
3.9
|
35.4
|
1.0
|
O
|
A:HOH396
|
3.9
|
37.6
|
1.0
|
OP1
|
A:G56
|
3.9
|
39.8
|
1.0
|
OP1
|
A:G38
|
4.0
|
20.2
|
1.0
|
O
|
A:HOH441
|
4.1
|
35.5
|
1.0
|
O
|
A:HOH431
|
4.1
|
31.2
|
1.0
|
O
|
A:HOH469
|
4.8
|
40.4
|
1.0
|
C5'
|
A:C39
|
4.9
|
31.0
|
1.0
|
OP2
|
A:G56
|
5.0
|
37.7
|
1.0
|
P
|
A:G56
|
5.0
|
37.0
|
1.0
|
|
Cobalt binding site 3 out
of 11 in 3got
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Cobalt Binding Sites List in 3got
Cobalt binding site 3 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 3 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co103
b:36.0
occ:1.00
|
CO
|
A:NCO103
|
0.0
|
36.0
|
1.0
|
N1
|
A:NCO103
|
2.0
|
33.1
|
1.0
|
N2
|
A:NCO103
|
2.0
|
34.4
|
1.0
|
N4
|
A:NCO103
|
2.0
|
37.4
|
1.0
|
N3
|
A:NCO103
|
2.0
|
31.8
|
1.0
|
N6
|
A:NCO103
|
2.0
|
36.9
|
1.0
|
N5
|
A:NCO103
|
2.0
|
36.1
|
1.0
|
O
|
A:HOH474
|
3.6
|
44.8
|
1.0
|
O4
|
A:U69
|
3.8
|
26.7
|
1.0
|
O
|
A:HOH446
|
3.8
|
47.1
|
1.0
|
O6
|
A:G56
|
3.9
|
28.1
|
1.0
|
O
|
A:HOH390
|
4.0
|
37.9
|
1.0
|
O
|
A:HOH309
|
4.1
|
28.2
|
1.0
|
O
|
A:HOH442
|
4.3
|
36.8
|
1.0
|
O
|
A:HOH500
|
4.3
|
53.5
|
1.0
|
N7
|
A:G56
|
4.4
|
25.9
|
1.0
|
OP2
|
A:C39
|
4.4
|
23.7
|
1.0
|
C6
|
A:G56
|
4.7
|
29.3
|
1.0
|
OP1
|
A:C39
|
4.8
|
24.5
|
1.0
|
O6
|
A:G68
|
4.8
|
24.6
|
1.0
|
C5
|
A:G56
|
4.9
|
28.4
|
1.0
|
|
Cobalt binding site 4 out
of 11 in 3got
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Cobalt Binding Sites List in 3got
Cobalt binding site 4 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 4 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co104
b:31.0
occ:1.00
|
CO
|
A:NCO104
|
0.0
|
31.0
|
1.0
|
N6
|
A:NCO104
|
2.0
|
27.0
|
1.0
|
N1
|
A:NCO104
|
2.0
|
29.1
|
1.0
|
N2
|
A:NCO104
|
2.0
|
28.0
|
1.0
|
N5
|
A:NCO104
|
2.0
|
27.4
|
1.0
|
N3
|
A:NCO104
|
2.0
|
28.1
|
1.0
|
N4
|
A:NCO104
|
2.0
|
24.2
|
1.0
|
O
|
A:HOH306
|
3.8
|
30.7
|
1.0
|
OP2
|
A:A66
|
3.8
|
33.3
|
1.0
|
O6
|
A:G32
|
3.8
|
24.5
|
1.0
|
O
|
A:HOH313
|
4.1
|
29.4
|
1.0
|
O6
|
A:G31
|
4.2
|
22.2
|
1.0
|
O
|
A:HOH408
|
4.3
|
26.9
|
1.0
|
O
|
A:HOH303
|
4.3
|
23.0
|
1.0
|
O
|
A:HOH322
|
4.4
|
31.5
|
1.0
|
N7
|
A:G31
|
4.4
|
24.5
|
1.0
|
O
|
A:HOH307
|
4.8
|
28.5
|
1.0
|
C6
|
A:G32
|
4.9
|
25.7
|
1.0
|
O4
|
A:U30
|
4.9
|
22.3
|
1.0
|
C6
|
A:G31
|
5.0
|
24.3
|
1.0
|
|
Cobalt binding site 5 out
of 11 in 3got
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Cobalt Binding Sites List in 3got
Cobalt binding site 5 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 5 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co105
b:66.5
occ:1.00
|
CO
|
A:NCO105
|
0.0
|
66.5
|
1.0
|
N5
|
A:NCO105
|
2.0
|
65.3
|
1.0
|
N4
|
A:NCO105
|
2.0
|
66.2
|
1.0
|
N2
|
A:NCO105
|
2.0
|
65.6
|
1.0
|
N6
|
A:NCO105
|
2.0
|
65.4
|
1.0
|
N1
|
A:NCO105
|
2.0
|
65.6
|
1.0
|
N3
|
A:NCO105
|
2.0
|
65.4
|
1.0
|
O
|
A:HOH459
|
3.5
|
42.6
|
1.0
|
O6
|
A:G38
|
4.1
|
22.9
|
1.0
|
OP2
|
A:G37
|
4.2
|
25.7
|
1.0
|
O
|
A:HOH312
|
4.2
|
31.2
|
1.0
|
N7
|
A:G38
|
4.4
|
23.5
|
1.0
|
O
|
A:HOH416
|
4.4
|
46.1
|
1.0
|
O
|
A:HOH370
|
4.4
|
48.3
|
1.0
|
O
|
A:HOH450
|
4.5
|
34.0
|
1.0
|
N7
|
A:G37
|
4.6
|
26.2
|
1.0
|
O
|
A:HOH440
|
4.8
|
33.5
|
1.0
|
C6
|
A:G38
|
5.0
|
25.8
|
1.0
|
|
Cobalt binding site 6 out
of 11 in 3got
Go back to
Cobalt Binding Sites List in 3got
Cobalt binding site 6 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 6 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co106
b:0.9
occ:1.00
|
CO
|
A:NCO106
|
0.0
|
0.9
|
1.0
|
N5
|
A:NCO106
|
2.0
|
0.5
|
1.0
|
N6
|
A:NCO106
|
2.0
|
0.2
|
1.0
|
N3
|
A:NCO106
|
2.0
|
0.3
|
1.0
|
N1
|
A:NCO106
|
2.0
|
0.4
|
1.0
|
N2
|
A:NCO106
|
2.0
|
0.3
|
1.0
|
N4
|
A:NCO106
|
2.0
|
0.3
|
1.0
|
O
|
A:HOH342
|
3.8
|
33.5
|
1.0
|
O
|
A:HOH373
|
3.9
|
42.9
|
1.0
|
O
|
A:HOH389
|
3.9
|
50.9
|
1.0
|
O
|
A:HOH326
|
4.1
|
25.4
|
1.0
|
O
|
A:HOH321
|
4.3
|
39.8
|
1.0
|
OP1
|
A:C26
|
4.4
|
44.2
|
1.0
|
O
|
A:HOH485
|
4.9
|
56.8
|
1.0
|
O
|
A:HOH462
|
4.9
|
46.8
|
1.0
|
|
Cobalt binding site 7 out
of 11 in 3got
Go back to
Cobalt Binding Sites List in 3got
Cobalt binding site 7 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 7 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co107
b:82.8
occ:1.00
|
CO
|
A:NCO107
|
0.0
|
82.8
|
1.0
|
N1
|
A:NCO107
|
2.0
|
81.7
|
1.0
|
N4
|
A:NCO107
|
2.0
|
81.5
|
1.0
|
N6
|
A:NCO107
|
2.0
|
81.5
|
1.0
|
N5
|
A:NCO107
|
2.0
|
81.9
|
1.0
|
N2
|
A:NCO107
|
2.0
|
81.6
|
1.0
|
N3
|
A:NCO107
|
2.0
|
81.8
|
1.0
|
O
|
A:HOH351
|
3.7
|
53.7
|
1.0
|
OP2
|
A:C41
|
3.8
|
26.9
|
1.0
|
OP1
|
A:C54
|
3.9
|
36.6
|
1.0
|
O
|
A:HOH366
|
4.3
|
33.7
|
1.0
|
O
|
A:HOH314
|
4.4
|
44.1
|
1.0
|
O
|
A:HOH325
|
4.4
|
28.4
|
1.0
|
OP2
|
A:G42
|
4.6
|
30.0
|
1.0
|
OP1
|
A:C53
|
4.8
|
37.4
|
1.0
|
P
|
A:C41
|
4.9
|
25.2
|
1.0
|
C5'
|
A:C54
|
5.0
|
33.9
|
1.0
|
OP2
|
A:C53
|
5.0
|
34.7
|
1.0
|
|
Cobalt binding site 8 out
of 11 in 3got
Go back to
Cobalt Binding Sites List in 3got
Cobalt binding site 8 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 8 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co108
b:67.6
occ:1.00
|
CO
|
A:NCO108
|
0.0
|
67.6
|
1.0
|
N3
|
A:NCO108
|
2.0
|
67.4
|
1.0
|
N6
|
A:NCO108
|
2.0
|
67.6
|
1.0
|
N1
|
A:NCO108
|
2.0
|
67.5
|
1.0
|
N2
|
A:NCO108
|
2.0
|
67.9
|
1.0
|
N4
|
A:NCO108
|
2.0
|
67.5
|
1.0
|
N5
|
A:NCO108
|
2.0
|
67.0
|
1.0
|
O4
|
A:U47
|
3.7
|
40.8
|
1.0
|
O
|
A:HOH445
|
4.2
|
44.9
|
1.0
|
OP2
|
A:U51
|
4.3
|
47.8
|
1.0
|
OP2
|
A:C50
|
4.7
|
47.4
|
1.0
|
C4
|
A:U47
|
4.7
|
40.0
|
1.0
|
O6
|
A:G46
|
4.7
|
31.4
|
1.0
|
OP1
|
A:C50
|
4.8
|
48.4
|
1.0
|
|
Cobalt binding site 9 out
of 11 in 3got
Go back to
Cobalt Binding Sites List in 3got
Cobalt binding site 9 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 9 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co109
b:67.7
occ:1.00
|
CO
|
A:NCO109
|
0.0
|
67.7
|
1.0
|
N1
|
A:NCO109
|
2.0
|
66.5
|
1.0
|
N3
|
A:NCO109
|
2.0
|
66.9
|
1.0
|
N2
|
A:NCO109
|
2.0
|
66.6
|
1.0
|
N4
|
A:NCO109
|
2.0
|
67.3
|
1.0
|
N5
|
A:NCO109
|
2.0
|
67.1
|
1.0
|
N6
|
A:NCO109
|
2.0
|
66.6
|
1.0
|
O
|
A:HOH315
|
3.7
|
47.5
|
1.0
|
O
|
A:HOH357
|
3.9
|
43.7
|
1.0
|
OP2
|
A:C71
|
4.0
|
26.6
|
1.0
|
OP1
|
A:A24
|
4.1
|
32.4
|
1.0
|
O
|
A:HOH400
|
4.8
|
27.6
|
1.0
|
O
|
A:HOH419
|
4.9
|
71.2
|
1.0
|
|
Cobalt binding site 10 out
of 11 in 3got
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Cobalt Binding Sites List in 3got
Cobalt binding site 10 out
of 11 in the Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine.
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 10 of Guanine Riboswitch C74U Mutant Bound to 2-Fluoroadenine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co111
b:1.0
occ:1.00
|
CO
|
A:NCO111
|
0.0
|
1.0
|
1.0
|
N5
|
A:NCO111
|
2.0
|
0.7
|
1.0
|
N2
|
A:NCO111
|
2.0
|
0.8
|
1.0
|
N4
|
A:NCO111
|
2.0
|
0.6
|
1.0
|
N6
|
A:NCO111
|
2.0
|
0.8
|
1.0
|
N1
|
A:NCO111
|
2.0
|
0.7
|
1.0
|
N3
|
A:NCO111
|
2.0
|
0.5
|
1.0
|
O
|
A:HOH387
|
3.8
|
64.5
|
1.0
|
O
|
A:HOH429
|
3.9
|
29.5
|
1.0
|
OP2
|
A:A33
|
4.1
|
30.0
|
1.0
|
O
|
A:HOH502
|
4.1
|
47.9
|
1.0
|
OP2
|
A:G32
|
4.2
|
27.9
|
1.0
|
O
|
A:HOH496
|
4.4
|
45.9
|
1.0
|
O
|
A:HOH329
|
4.7
|
37.8
|
1.0
|
O
|
A:HOH364
|
4.8
|
44.8
|
1.0
|
O
|
A:HOH417
|
4.9
|
51.3
|
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
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