Potassium in PDB 4ts0: Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Protein crystallography data
The structure of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions, PDB code: 4ts0
was solved by
K.D.Warner,
M.C.Chen,
W.Song,
R.L.Strack,
A.Thorn,
S.R.Jaffrey,
A.R.Ferre-D'amare,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
50.00 /
2.80
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
39.760,
49.500,
186.260,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
20.6 /
23.9
|
Other elements in 4ts0:
The structure of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions also contains other interesting chemical elements:
Potassium Binding Sites:
The binding sites of Potassium atom in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
(pdb code 4ts0). This binding sites where shown within
5.0 Angstroms radius around Potassium atom.
In total 10 binding sites of Potassium where determined in the
Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions, PDB code: 4ts0:
Jump to Potassium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Potassium binding site 1 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 1 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 1 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
X:K102
b:66.8
occ:1.00
|
O6
|
X:G26
|
2.6
|
72.4
|
1.0
|
O6
|
Y:G68
|
2.6
|
61.5
|
1.0
|
O6
|
Y:G70
|
2.7
|
63.3
|
1.0
|
O6
|
X:G30
|
2.8
|
67.3
|
1.0
|
O6
|
Y:G65
|
2.9
|
62.9
|
1.0
|
O6
|
Y:G72
|
2.9
|
58.1
|
1.0
|
O6
|
X:G25
|
3.0
|
59.1
|
1.0
|
O6
|
X:G29
|
3.2
|
67.8
|
1.0
|
C6
|
X:G26
|
3.4
|
65.7
|
1.0
|
C6
|
X:G30
|
3.5
|
69.3
|
1.0
|
C6
|
Y:G68
|
3.6
|
59.1
|
1.0
|
N1
|
X:G26
|
3.6
|
63.0
|
1.0
|
C6
|
X:G25
|
3.6
|
61.2
|
1.0
|
N1
|
X:G30
|
3.7
|
65.2
|
1.0
|
C6
|
Y:G70
|
3.7
|
57.6
|
1.0
|
C6
|
Y:G65
|
3.8
|
60.0
|
1.0
|
K
|
X:K109
|
3.8
|
65.4
|
1.0
|
N1
|
X:G25
|
3.9
|
60.8
|
1.0
|
C6
|
Y:G72
|
3.9
|
53.3
|
1.0
|
N1
|
Y:G68
|
4.0
|
57.2
|
1.0
|
N1
|
Y:G65
|
4.0
|
57.1
|
1.0
|
C6
|
X:G29
|
4.0
|
67.3
|
1.0
|
N1
|
Y:G72
|
4.1
|
55.0
|
1.0
|
N1
|
Y:G70
|
4.2
|
54.7
|
1.0
|
N1
|
X:G29
|
4.2
|
64.4
|
1.0
|
C5
|
X:G25
|
4.7
|
58.1
|
1.0
|
C5
|
X:G26
|
4.7
|
63.9
|
1.0
|
C5
|
Y:G68
|
4.7
|
53.4
|
1.0
|
C5
|
X:G30
|
4.8
|
63.9
|
1.0
|
C2
|
X:G26
|
4.9
|
64.6
|
1.0
|
C5
|
Y:G70
|
4.9
|
53.0
|
1.0
|
C2
|
X:G30
|
4.9
|
64.0
|
1.0
|
N1
|
X:G31
|
4.9
|
58.7
|
1.0
|
C2
|
X:G25
|
5.0
|
61.8
|
1.0
|
|
Potassium binding site 2 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 2 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 2 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
X:K103
b:0.8
occ:1.00
|
O
|
X:HOH201
|
2.1
|
87.8
|
1.0
|
O
|
Y:HOH201
|
2.4
|
81.8
|
1.0
|
O6
|
X:G40
|
3.7
|
0.1
|
1.0
|
O6
|
X:G39
|
4.2
|
0.8
|
1.0
|
O
|
Y:HOH202
|
4.4
|
94.8
|
1.0
|
N4
|
Y:C53
|
4.5
|
0.4
|
1.0
|
N7
|
X:G39
|
4.8
|
0.5
|
1.0
|
C6
|
X:G40
|
4.8
|
0.2
|
1.0
|
|
Potassium binding site 3 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 3 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 3 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
X:K104
b:97.5
occ:1.00
|
O
|
X:HOH204
|
2.3
|
59.3
|
1.0
|
O
|
Y:HOH205
|
2.6
|
72.0
|
1.0
|
O
|
X:HOH203
|
3.0
|
54.8
|
1.0
|
OP2
|
X:A23
|
3.3
|
57.5
|
1.0
|
O
|
Y:HOH206
|
3.4
|
70.0
|
1.0
|
O
|
X:HOH205
|
3.5
|
65.5
|
1.0
|
O4
|
Y:U73
|
4.5
|
70.4
|
1.0
|
O2'
|
Y:U66
|
4.6
|
54.1
|
1.0
|
P
|
X:A23
|
4.6
|
55.3
|
1.0
|
C5'
|
Y:A67
|
4.9
|
50.1
|
1.0
|
O
|
Y:HOH207
|
4.9
|
67.6
|
1.0
|
O5'
|
X:A23
|
4.9
|
50.8
|
1.0
|
|
Potassium binding site 4 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 4 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 4 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
X:K105
b:91.2
occ:1.00
|
OP1
|
X:A16
|
2.8
|
72.8
|
1.0
|
O4
|
X:U18
|
2.9
|
70.8
|
1.0
|
O2'
|
X:G14
|
2.9
|
75.0
|
1.0
|
N7
|
X:A17
|
3.0
|
54.3
|
1.0
|
O3'
|
X:A15
|
3.5
|
83.8
|
1.0
|
P
|
X:A16
|
3.6
|
77.7
|
1.0
|
C8
|
X:A17
|
3.7
|
52.2
|
1.0
|
C2'
|
X:G14
|
3.7
|
78.6
|
1.0
|
C4
|
X:U18
|
3.7
|
62.4
|
1.0
|
C5
|
X:U18
|
4.2
|
65.2
|
1.0
|
C5
|
X:A17
|
4.2
|
55.2
|
1.0
|
OP2
|
X:A16
|
4.2
|
81.1
|
1.0
|
N6
|
X:A17
|
4.5
|
68.9
|
1.0
|
C3'
|
X:A15
|
4.7
|
88.7
|
1.0
|
C5'
|
X:A15
|
4.8
|
88.8
|
1.0
|
C6
|
X:A17
|
4.8
|
61.8
|
1.0
|
C3'
|
X:G14
|
4.8
|
89.3
|
1.0
|
C1'
|
X:G14
|
4.9
|
75.5
|
1.0
|
N3
|
X:U18
|
4.9
|
63.4
|
1.0
|
C4'
|
X:A15
|
4.9
|
86.5
|
1.0
|
N9
|
X:A17
|
5.0
|
52.4
|
1.0
|
N9
|
X:G14
|
5.0
|
68.7
|
1.0
|
|
Potassium binding site 5 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 5 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 5 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
X:K106
b:89.2
occ:1.00
|
O
|
Y:HOH203
|
2.6
|
66.7
|
1.0
|
O
|
Y:HOH208
|
2.8
|
69.4
|
1.0
|
F1
|
Y:38E107
|
3.0
|
68.9
|
1.0
|
O2'
|
X:G25
|
3.0
|
64.5
|
1.0
|
OP2
|
X:G26
|
3.0
|
74.0
|
1.0
|
O3'
|
X:G25
|
3.3
|
70.7
|
1.0
|
O
|
Y:HOH204
|
3.4
|
69.4
|
1.0
|
P
|
X:G26
|
3.7
|
79.3
|
1.0
|
OP2
|
Y:A64
|
3.9
|
69.5
|
1.0
|
C2'
|
X:G25
|
4.1
|
63.0
|
1.0
|
OP2
|
Y:U66
|
4.1
|
53.9
|
1.0
|
C3'
|
X:G25
|
4.1
|
61.5
|
1.0
|
K
|
X:K110
|
4.1
|
88.4
|
1.0
|
C2
|
Y:38E107
|
4.2
|
62.5
|
1.0
|
O5'
|
X:G26
|
4.4
|
74.7
|
1.0
|
C8
|
X:G26
|
4.6
|
66.3
|
1.0
|
O1
|
Y:38E107
|
4.6
|
63.6
|
1.0
|
C1
|
Y:38E107
|
4.9
|
59.1
|
1.0
|
N2
|
Y:G65
|
4.9
|
70.5
|
1.0
|
C1'
|
X:G25
|
5.0
|
59.6
|
1.0
|
|
Potassium binding site 6 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 6 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 6 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
X:K109
b:65.4
occ:1.00
|
O2
|
Y:U73
|
2.7
|
59.7
|
1.0
|
O6
|
X:G25
|
2.7
|
59.1
|
1.0
|
O6
|
Y:G68
|
2.8
|
61.5
|
1.0
|
O2'
|
Y:U73
|
2.9
|
57.4
|
1.0
|
O6
|
Y:G72
|
3.1
|
58.1
|
1.0
|
O6
|
Y:G74
|
3.1
|
65.9
|
1.0
|
N7
|
Y:G74
|
3.2
|
59.4
|
1.0
|
O6
|
X:G29
|
3.5
|
67.8
|
1.0
|
C6
|
Y:G72
|
3.5
|
53.3
|
1.0
|
C6
|
Y:G68
|
3.7
|
59.1
|
1.0
|
C6
|
Y:G74
|
3.8
|
62.3
|
1.0
|
C6
|
X:G25
|
3.8
|
61.2
|
1.0
|
N1
|
Y:G72
|
3.8
|
55.0
|
1.0
|
K
|
X:K102
|
3.8
|
66.8
|
1.0
|
C5
|
Y:G74
|
3.8
|
58.5
|
1.0
|
C2
|
Y:U73
|
3.8
|
62.6
|
1.0
|
C2'
|
Y:U73
|
3.9
|
59.1
|
1.0
|
N1
|
X:G29
|
4.0
|
64.4
|
1.0
|
N1
|
X:G25
|
4.1
|
60.8
|
1.0
|
C6
|
X:G29
|
4.1
|
67.3
|
1.0
|
C1'
|
Y:U73
|
4.1
|
63.3
|
1.0
|
N1
|
Y:G68
|
4.2
|
57.2
|
1.0
|
C8
|
Y:G74
|
4.3
|
61.7
|
1.0
|
C5
|
Y:G72
|
4.5
|
49.6
|
1.0
|
N1
|
Y:U73
|
4.5
|
63.7
|
1.0
|
C2
|
Y:G72
|
4.8
|
54.2
|
1.0
|
C5
|
Y:G68
|
4.8
|
53.4
|
1.0
|
N3
|
Y:U73
|
4.9
|
68.0
|
1.0
|
N4
|
X:C28
|
5.0
|
69.1
|
1.0
|
|
Potassium binding site 7 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 7 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 7 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
X:K110
b:88.4
occ:1.00
|
O
|
Y:HOH204
|
2.4
|
69.4
|
1.0
|
O2'
|
Y:U61
|
2.5
|
0.0
|
1.0
|
OP2
|
X:G26
|
2.9
|
74.0
|
1.0
|
O
|
Y:HOH203
|
2.9
|
66.7
|
1.0
|
O3'
|
Y:U61
|
3.1
|
0.9
|
1.0
|
OP2
|
Y:U62
|
3.1
|
0.4
|
1.0
|
O5'
|
X:G26
|
3.4
|
74.7
|
1.0
|
P
|
X:G26
|
3.7
|
79.3
|
1.0
|
P
|
Y:U62
|
3.7
|
1.0
|
1.0
|
C2'
|
Y:U61
|
3.7
|
0.9
|
1.0
|
C3'
|
Y:U61
|
4.0
|
0.8
|
1.0
|
K
|
X:K106
|
4.1
|
89.2
|
1.0
|
C1'
|
Y:U61
|
4.4
|
97.0
|
1.0
|
C3'
|
X:G26
|
4.5
|
83.6
|
1.0
|
C2'
|
X:G26
|
4.5
|
83.6
|
1.0
|
OP2
|
Y:A64
|
4.5
|
69.5
|
1.0
|
C5'
|
X:G26
|
4.7
|
74.8
|
1.0
|
O3'
|
X:G25
|
4.8
|
70.7
|
1.0
|
O5'
|
Y:U62
|
4.8
|
0.4
|
1.0
|
O1
|
Y:38E107
|
4.8
|
63.6
|
1.0
|
OP1
|
X:G26
|
4.8
|
70.0
|
1.0
|
OP1
|
Y:U62
|
4.8
|
0.3
|
1.0
|
|
Potassium binding site 8 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 8 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 8 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
Y:K104
b:84.4
occ:1.00
|
O4
|
Y:U86
|
3.0
|
61.3
|
1.0
|
O6
|
Y:G87
|
3.1
|
67.9
|
1.0
|
N7
|
Y:G87
|
3.7
|
59.3
|
1.0
|
C4
|
Y:U86
|
3.7
|
55.5
|
1.0
|
C5
|
Y:U86
|
3.9
|
55.4
|
1.0
|
C6
|
Y:G87
|
3.9
|
63.4
|
1.0
|
C5
|
Y:G87
|
4.1
|
58.7
|
1.0
|
N4
|
X:C9
|
4.4
|
67.6
|
1.0
|
N6
|
X:A12
|
4.6
|
64.1
|
1.0
|
OP2
|
Y:C85
|
4.7
|
53.0
|
1.0
|
C8
|
Y:G87
|
4.9
|
61.3
|
1.0
|
N3
|
Y:U86
|
4.9
|
56.2
|
1.0
|
|
Potassium binding site 9 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 9 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 9 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
Y:K105
b:71.9
occ:1.00
|
OP1
|
Y:A84
|
2.8
|
59.4
|
1.0
|
O3'
|
Y:A83
|
4.0
|
58.6
|
1.0
|
P
|
Y:A84
|
4.0
|
62.6
|
1.0
|
C5'
|
Y:A84
|
4.9
|
56.6
|
1.0
|
|
Potassium binding site 10 out
of 10 in 4ts0
Go back to
Potassium Binding Sites List in 4ts0
Potassium binding site 10 out
of 10 in the Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 10 of Crystal Structure of the Spinach Rna Aptamer in Complex with Dfhbi, Barium Ions within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
Y:K106
b:0.5
occ:1.00
|
O6
|
Y:G56
|
3.4
|
0.5
|
1.0
|
O6
|
X:G36
|
3.8
|
76.3
|
1.0
|
N4
|
Y:C57
|
4.1
|
0.5
|
1.0
|
N4
|
X:C37
|
4.3
|
0.7
|
1.0
|
C6
|
Y:G56
|
4.6
|
0.4
|
1.0
|
N6
|
X:A35
|
4.8
|
68.0
|
1.0
|
C6
|
X:G36
|
4.9
|
79.3
|
1.0
|
N7
|
X:G36
|
4.9
|
81.7
|
1.0
|
|
Reference:
K.D.Warner,
M.C.Chen,
W.Song,
R.L.Strack,
A.Thorn,
S.R.Jaffrey,
A.R.Ferre-D'amare.
Structural Basis For Activity of Highly Efficient Rna Mimics of Green Fluorescent Protein. Nat.Struct.Mol.Biol. V. 21 658 2014.
ISSN: ESSN 1545-9985
PubMed: 25026079
DOI: 10.1038/NSMB.2865
Page generated: Mon Aug 12 12:11:23 2024
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