Cobalt in PDB 6vmy: Structure of the B. Subtilis Cobalamin Riboswitch
Protein crystallography data
The structure of Structure of the B. Subtilis Cobalamin Riboswitch, PDB code: 6vmy
was solved by
C.W.Chan,
A.Mondragon,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
39.21 /
3.25
|
Space group
|
P 65 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
118.282,
118.282,
261.547,
90.00,
90.00,
120.00
|
R / Rfree (%)
|
26.3 /
27.9
|
Other elements in 6vmy:
The structure of Structure of the B. Subtilis Cobalamin Riboswitch also contains other interesting chemical elements:
Cobalt Binding Sites:
The binding sites of Cobalt atom in the Structure of the B. Subtilis Cobalamin Riboswitch
(pdb code 6vmy). This binding sites where shown within
5.0 Angstroms radius around Cobalt atom.
In total 8 binding sites of Cobalt where determined in the
Structure of the B. Subtilis Cobalamin Riboswitch, PDB code: 6vmy:
Jump to Cobalt binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Cobalt binding site 1 out
of 8 in 6vmy
Go back to
Cobalt Binding Sites List in 6vmy
Cobalt binding site 1 out
of 8 in the Structure of the B. Subtilis Cobalamin Riboswitch
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 1 of Structure of the B. Subtilis Cobalamin Riboswitch within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co405
b:0.4
occ:1.00
|
CO
|
A:NCO405
|
0.0
|
0.4
|
1.0
|
N2
|
A:NCO405
|
2.0
|
0.3
|
1.0
|
N4
|
A:NCO405
|
2.0
|
1.0
|
1.0
|
N3
|
A:NCO405
|
2.0
|
0.4
|
1.0
|
N6
|
A:NCO405
|
2.0
|
0.1
|
1.0
|
N1
|
A:NCO405
|
2.0
|
0.5
|
1.0
|
N5
|
A:NCO405
|
2.0
|
0.4
|
1.0
|
O6
|
A:G212
|
4.2
|
0.3
|
1.0
|
O4
|
A:U213
|
4.4
|
0.7
|
1.0
|
OP2
|
A:U311
|
4.7
|
99.4
|
1.0
|
|
Cobalt binding site 2 out
of 8 in 6vmy
Go back to
Cobalt Binding Sites List in 6vmy
Cobalt binding site 2 out
of 8 in the Structure of the B. Subtilis Cobalamin Riboswitch
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 2 of Structure of the B. Subtilis Cobalamin Riboswitch within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co406
b:1.0
occ:1.00
|
CO
|
A:NCO406
|
0.0
|
1.0
|
1.0
|
N6
|
A:NCO406
|
2.0
|
0.7
|
1.0
|
N2
|
A:NCO406
|
2.0
|
0.6
|
1.0
|
N3
|
A:NCO406
|
2.0
|
0.0
|
1.0
|
N5
|
A:NCO406
|
2.0
|
0.4
|
1.0
|
N4
|
A:NCO406
|
2.0
|
0.5
|
1.0
|
N1
|
A:NCO406
|
2.0
|
0.1
|
1.0
|
OP2
|
A:C271
|
4.1
|
0.4
|
1.0
|
O6
|
A:G268
|
4.2
|
0.4
|
1.0
|
N2
|
A:NCO408
|
4.3
|
0.0
|
1.0
|
N4
|
A:C274
|
4.4
|
0.4
|
1.0
|
OP2
|
A:C272
|
4.6
|
0.7
|
1.0
|
N3
|
A:NCO408
|
5.0
|
0.6
|
1.0
|
|
Cobalt binding site 3 out
of 8 in 6vmy
Go back to
Cobalt Binding Sites List in 6vmy
Cobalt binding site 3 out
of 8 in the Structure of the B. Subtilis Cobalamin Riboswitch
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 3 of Structure of the B. Subtilis Cobalamin Riboswitch within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co407
b:0.9
occ:1.00
|
CO
|
A:NCO407
|
0.0
|
0.9
|
1.0
|
N4
|
A:NCO407
|
2.0
|
0.1
|
1.0
|
N2
|
A:NCO407
|
2.0
|
1.0
|
1.0
|
N6
|
A:NCO407
|
2.0
|
0.5
|
1.0
|
N1
|
A:NCO407
|
2.0
|
0.6
|
1.0
|
N3
|
A:NCO407
|
2.0
|
0.3
|
1.0
|
N5
|
A:NCO407
|
2.0
|
0.2
|
1.0
|
O6
|
A:G224
|
4.3
|
0.6
|
1.0
|
N7
|
A:G222
|
4.5
|
0.3
|
1.0
|
O6
|
A:G222
|
4.9
|
0.7
|
1.0
|
|
Cobalt binding site 4 out
of 8 in 6vmy
Go back to
Cobalt Binding Sites List in 6vmy
Cobalt binding site 4 out
of 8 in the Structure of the B. Subtilis Cobalamin Riboswitch
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 4 of Structure of the B. Subtilis Cobalamin Riboswitch within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co408
b:0.1
occ:1.00
|
CO
|
A:NCO408
|
0.0
|
0.1
|
1.0
|
N2
|
A:NCO408
|
2.0
|
0.0
|
1.0
|
N4
|
A:NCO408
|
2.0
|
0.1
|
1.0
|
N1
|
A:NCO408
|
2.0
|
0.8
|
1.0
|
N5
|
A:NCO408
|
2.0
|
0.9
|
1.0
|
N3
|
A:NCO408
|
2.0
|
0.6
|
1.0
|
N6
|
A:NCO408
|
2.0
|
0.5
|
1.0
|
OP2
|
A:G267
|
3.7
|
0.1
|
1.0
|
OP1
|
A:C270
|
3.8
|
0.7
|
1.0
|
N6
|
A:NCO406
|
4.7
|
0.7
|
1.0
|
N7
|
A:G267
|
4.9
|
0.4
|
1.0
|
N3
|
A:NCO406
|
4.9
|
0.0
|
1.0
|
P
|
A:G267
|
5.0
|
0.6
|
1.0
|
C8
|
A:G267
|
5.0
|
0.2
|
1.0
|
|
Cobalt binding site 5 out
of 8 in 6vmy
Go back to
Cobalt Binding Sites List in 6vmy
Cobalt binding site 5 out
of 8 in the Structure of the B. Subtilis Cobalamin Riboswitch
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 5 of Structure of the B. Subtilis Cobalamin Riboswitch within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co409
b:0.7
occ:1.00
|
CO
|
A:NCO409
|
0.0
|
0.7
|
1.0
|
N2
|
A:NCO409
|
2.0
|
0.8
|
1.0
|
N4
|
A:NCO409
|
2.0
|
0.7
|
1.0
|
N6
|
A:NCO409
|
2.0
|
0.2
|
1.0
|
N3
|
A:NCO409
|
2.0
|
0.2
|
1.0
|
N1
|
A:NCO409
|
2.0
|
0.7
|
1.0
|
N5
|
A:NCO409
|
2.0
|
0.9
|
1.0
|
O4
|
A:U219
|
4.3
|
0.2
|
1.0
|
N7
|
A:G217
|
4.4
|
0.9
|
1.0
|
O6
|
A:G218
|
4.6
|
0.5
|
1.0
|
OP2
|
A:C230
|
4.6
|
0.9
|
1.0
|
OP1
|
A:C230
|
4.9
|
1.0
|
1.0
|
N7
|
A:G218
|
5.0
|
0.8
|
1.0
|
|
Cobalt binding site 6 out
of 8 in 6vmy
Go back to
Cobalt Binding Sites List in 6vmy
Cobalt binding site 6 out
of 8 in the Structure of the B. Subtilis Cobalamin Riboswitch
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 6 of Structure of the B. Subtilis Cobalamin Riboswitch within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co410
b:0.7
occ:1.00
|
CO
|
A:NCO410
|
0.0
|
0.7
|
1.0
|
N3
|
A:NCO410
|
2.0
|
0.9
|
1.0
|
N2
|
A:NCO410
|
2.0
|
1.0
|
1.0
|
N6
|
A:NCO410
|
2.0
|
0.9
|
1.0
|
N5
|
A:NCO410
|
2.0
|
0.6
|
1.0
|
N1
|
A:NCO410
|
2.0
|
1.0
|
1.0
|
N4
|
A:NCO410
|
2.0
|
0.0
|
1.0
|
|
Cobalt binding site 7 out
of 8 in 6vmy
Go back to
Cobalt Binding Sites List in 6vmy
Cobalt binding site 7 out
of 8 in the Structure of the B. Subtilis Cobalamin Riboswitch
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 7 of Structure of the B. Subtilis Cobalamin Riboswitch within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co411
b:0.1
occ:1.00
|
CO
|
A:NCO411
|
0.0
|
0.1
|
1.0
|
N4
|
A:NCO411
|
2.0
|
0.6
|
1.0
|
N6
|
A:NCO411
|
2.0
|
0.2
|
1.0
|
N2
|
A:NCO411
|
2.0
|
0.7
|
1.0
|
N1
|
A:NCO411
|
2.0
|
0.1
|
1.0
|
N5
|
A:NCO411
|
2.0
|
0.9
|
1.0
|
N3
|
A:NCO411
|
2.0
|
0.4
|
1.0
|
O2'
|
A:A231
|
3.8
|
0.2
|
1.0
|
OP1
|
A:G305
|
4.2
|
96.3
|
1.0
|
N0A
|
A:B1Z412
|
4.5
|
80.8
|
1.0
|
C6
|
A:U307
|
4.5
|
0.6
|
1.0
|
OP2
|
A:G305
|
4.5
|
99.5
|
1.0
|
N7
|
A:A308
|
4.6
|
92.6
|
1.0
|
C4'
|
A:A231
|
4.6
|
0.3
|
1.0
|
P
|
A:G305
|
4.7
|
96.2
|
1.0
|
C1'
|
A:U307
|
4.8
|
0.1
|
1.0
|
O4'
|
A:U307
|
4.8
|
0.9
|
1.0
|
N1
|
A:U307
|
4.9
|
0.1
|
1.0
|
C2'
|
A:A231
|
4.9
|
0.9
|
1.0
|
O4'
|
A:G305
|
4.9
|
0.4
|
1.0
|
O3'
|
A:A231
|
4.9
|
0.7
|
1.0
|
O5'
|
A:G305
|
4.9
|
96.3
|
1.0
|
C4'
|
A:G305
|
5.0
|
0.0
|
1.0
|
C5'
|
A:A306
|
5.0
|
1.0
|
1.0
|
|
Cobalt binding site 8 out
of 8 in 6vmy
Go back to
Cobalt Binding Sites List in 6vmy
Cobalt binding site 8 out
of 8 in the Structure of the B. Subtilis Cobalamin Riboswitch
Mono view
Stereo pair view
|
A full contact list of Cobalt with other atoms in the Co binding
site number 8 of Structure of the B. Subtilis Cobalamin Riboswitch within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Co412
b:87.0
occ:1.00
|
CO
|
A:B1Z412
|
0.0
|
87.0
|
1.0
|
N21
|
A:B1Z412
|
1.9
|
84.9
|
1.0
|
N24
|
A:B1Z412
|
1.9
|
87.8
|
1.0
|
N22
|
A:B1Z412
|
1.9
|
87.2
|
1.0
|
N23
|
A:B1Z412
|
1.9
|
88.0
|
1.0
|
C5A
|
A:B1Z412
|
2.1
|
86.7
|
1.0
|
N3B
|
A:B1Z412
|
2.2
|
95.0
|
1.0
|
C9
|
A:B1Z412
|
2.9
|
87.5
|
1.0
|
C19
|
A:B1Z412
|
2.9
|
87.5
|
1.0
|
C1
|
A:B1Z412
|
2.9
|
85.6
|
1.0
|
C4
|
A:B1Z412
|
2.9
|
84.4
|
1.0
|
C11
|
A:B1Z412
|
2.9
|
88.8
|
1.0
|
C6
|
A:B1Z412
|
3.0
|
86.0
|
1.0
|
C16
|
A:B1Z412
|
3.0
|
90.0
|
1.0
|
C14
|
A:B1Z412
|
3.0
|
91.6
|
1.0
|
C4A
|
A:B1Z412
|
3.1
|
86.2
|
1.0
|
C2B
|
A:B1Z412
|
3.2
|
98.1
|
1.0
|
C10
|
A:B1Z412
|
3.3
|
87.3
|
1.0
|
C5
|
A:B1Z412
|
3.3
|
84.1
|
1.0
|
C9B
|
A:B1Z412
|
3.3
|
97.4
|
1.0
|
C15
|
A:B1Z412
|
3.4
|
91.6
|
1.0
|
C20
|
A:B1Z412
|
3.5
|
86.5
|
1.0
|
O6A
|
A:B1Z412
|
3.8
|
84.8
|
1.0
|
C4B
|
A:B1Z412
|
3.8
|
97.2
|
1.0
|
C18
|
A:B1Z412
|
4.1
|
88.8
|
1.0
|
C2
|
A:B1Z412
|
4.1
|
85.0
|
1.0
|
C3
|
A:B1Z412
|
4.2
|
86.0
|
1.0
|
C8
|
A:B1Z412
|
4.2
|
88.3
|
1.0
|
C7
|
A:B1Z412
|
4.2
|
87.5
|
1.0
|
C17
|
A:B1Z412
|
4.2
|
90.9
|
1.0
|
C12
|
A:B1Z412
|
4.2
|
91.7
|
1.0
|
C13
|
A:B1Z412
|
4.3
|
92.7
|
1.0
|
N1B
|
A:B1Z412
|
4.4
|
0.2
|
1.0
|
C3A
|
A:B1Z412
|
4.4
|
87.3
|
1.0
|
C8B
|
A:B1Z412
|
4.5
|
99.3
|
1.0
|
C26
|
A:B1Z412
|
4.6
|
84.8
|
1.0
|
C35
|
A:B1Z412
|
4.8
|
83.5
|
1.0
|
O8A
|
A:B1Z412
|
4.8
|
88.5
|
1.0
|
C37
|
A:B1Z412
|
4.9
|
88.0
|
1.0
|
C53
|
A:B1Z412
|
4.9
|
92.5
|
1.0
|
C41
|
A:B1Z412
|
5.0
|
89.8
|
1.0
|
C54
|
A:B1Z412
|
5.0
|
91.9
|
1.0
|
|
Reference:
C.W.Chan,
A.Mondragon.
Crystal Structure of An Atypical Cobalamin Riboswitch Reveals Rna Structural Adaptability As Basis For Promiscuous Ligand Binding To Be Published.
Page generated: Tue Jul 30 19:02:22 2024
|