Magnesium in PDB 1egk: Crystal Structure of A Nucleic Acid Four-Way Junction
Protein crystallography data
The structure of Crystal Structure of A Nucleic Acid Four-Way Junction, PDB code: 1egk
was solved by
J.Nowakowski,
P.J.Shim,
C.D.Stout,
G.F.Joyce,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
15.00 /
3.10
|
Space group
|
I 2 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
62.810,
114.260,
171.450,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
22.6 /
25.8
|
Magnesium Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
14;
Binding sites:
The binding sites of Magnesium atom in the Crystal Structure of A Nucleic Acid Four-Way Junction
(pdb code 1egk). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 14 binding sites of Magnesium where determined in the
Crystal Structure of A Nucleic Acid Four-Way Junction, PDB code: 1egk:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Magnesium binding site 1 out
of 14 in 1egk
Go back to
Magnesium Binding Sites List in 1egk
Magnesium binding site 1 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg21
b:74.5
occ:1.00
|
O
|
A:HOH31
|
2.0
|
74.5
|
1.0
|
O
|
A:HOH28
|
2.0
|
74.5
|
1.0
|
O
|
A:HOH32
|
2.0
|
74.5
|
1.0
|
O
|
A:HOH33
|
2.0
|
74.5
|
1.0
|
O
|
A:HOH30
|
2.1
|
74.5
|
1.0
|
O
|
A:HOH29
|
2.1
|
74.5
|
1.0
|
N7
|
A:G3
|
4.2
|
55.3
|
1.0
|
O6
|
A:G3
|
4.3
|
55.3
|
1.0
|
N7
|
A:G2
|
4.6
|
51.5
|
1.0
|
O6
|
A:G2
|
5.0
|
51.5
|
1.0
|
|
Magnesium binding site 2 out
of 14 in 1egk
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Magnesium Binding Sites List in 1egk
Magnesium binding site 2 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg22
b:0.7
occ:1.00
|
O
|
B:HOH56
|
2.0
|
0.7
|
1.0
|
O
|
B:HOH55
|
2.1
|
0.7
|
1.0
|
O
|
B:HOH58
|
2.1
|
0.7
|
1.0
|
O
|
B:HOH59
|
2.1
|
0.7
|
1.0
|
O
|
B:HOH60
|
2.1
|
0.7
|
1.0
|
O
|
B:HOH57
|
2.1
|
0.7
|
1.0
|
O6
|
B:DG31
|
4.3
|
54.7
|
1.0
|
O6
|
A:G9
|
4.9
|
54.4
|
1.0
|
|
Magnesium binding site 3 out
of 14 in 1egk
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Magnesium Binding Sites List in 1egk
Magnesium binding site 3 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg23
b:91.5
occ:1.00
|
O
|
A:HOH36
|
2.0
|
91.5
|
1.0
|
O
|
A:HOH34
|
2.0
|
91.5
|
1.0
|
O
|
A:HOH35
|
2.0
|
91.5
|
1.0
|
O
|
A:HOH37
|
2.1
|
91.5
|
1.0
|
O
|
A:HOH39
|
2.1
|
91.5
|
1.0
|
O
|
A:HOH38
|
2.1
|
91.5
|
1.0
|
O6
|
A:G18
|
4.1
|
67.4
|
1.0
|
N6
|
A:A19
|
4.4
|
57.9
|
1.0
|
N4
|
A:C17
|
4.6
|
56.5
|
1.0
|
N7
|
A:G18
|
4.7
|
67.4
|
1.0
|
C6
|
A:G18
|
5.0
|
67.4
|
1.0
|
|
Magnesium binding site 4 out
of 14 in 1egk
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Magnesium Binding Sites List in 1egk
Magnesium binding site 4 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg24
b:0.3
occ:1.00
|
O
|
A:HOH43
|
2.1
|
0.3
|
1.0
|
O
|
A:HOH44
|
2.1
|
0.3
|
1.0
|
O
|
A:HOH42
|
2.1
|
0.3
|
1.0
|
O
|
A:HOH40
|
2.1
|
0.3
|
1.0
|
O
|
A:HOH41
|
2.1
|
0.3
|
1.0
|
O
|
A:HOH45
|
2.1
|
0.3
|
1.0
|
OP2
|
A:A19
|
4.3
|
57.5
|
1.0
|
|
Magnesium binding site 5 out
of 14 in 1egk
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Magnesium Binding Sites List in 1egk
Magnesium binding site 5 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg25
b:0.4
occ:1.00
|
O
|
B:HOH65
|
2.1
|
0.4
|
1.0
|
O
|
A:HOH48
|
2.1
|
0.4
|
1.0
|
O
|
D:HOH70
|
2.1
|
0.4
|
1.0
|
O
|
B:HOH66
|
2.1
|
0.4
|
1.0
|
O
|
A:HOH47
|
2.1
|
0.4
|
1.0
|
O
|
A:HOH46
|
2.1
|
0.4
|
1.0
|
OP1
|
A:G3
|
2.9
|
61.5
|
1.0
|
O6
|
D:DG136
|
3.7
|
81.1
|
1.0
|
O6
|
B:DG32
|
3.7
|
62.0
|
1.0
|
P
|
A:G3
|
4.3
|
61.5
|
1.0
|
N7
|
D:DG136
|
4.5
|
81.1
|
1.0
|
C6
|
D:DG136
|
4.7
|
81.1
|
1.0
|
N7
|
B:DG32
|
4.7
|
62.0
|
1.0
|
C6
|
B:DG32
|
4.7
|
62.0
|
1.0
|
O3'
|
A:G2
|
4.8
|
53.7
|
1.0
|
N4
|
B:DC33
|
4.8
|
85.8
|
1.0
|
N7
|
D:DA135
|
4.9
|
98.3
|
1.0
|
|
Magnesium binding site 6 out
of 14 in 1egk
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Magnesium Binding Sites List in 1egk
Magnesium binding site 6 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg26
b:0.4
occ:1.00
|
O
|
A:HOH54
|
2.0
|
0.4
|
1.0
|
O
|
A:HOH49
|
2.1
|
0.4
|
1.0
|
O
|
A:HOH50
|
2.1
|
0.4
|
1.0
|
O
|
A:HOH51
|
2.1
|
0.4
|
1.0
|
O
|
A:HOH53
|
2.1
|
0.4
|
1.0
|
O
|
A:HOH52
|
2.1
|
0.4
|
1.0
|
O6
|
A:G16
|
3.6
|
70.0
|
1.0
|
O4
|
A:U15
|
3.9
|
60.3
|
1.0
|
C5
|
A:U15
|
4.5
|
60.3
|
1.0
|
C4
|
A:U15
|
4.5
|
60.3
|
1.0
|
N4
|
B:DC25
|
4.6
|
50.3
|
1.0
|
C6
|
A:G16
|
4.7
|
70.0
|
1.0
|
|
Magnesium binding site 7 out
of 14 in 1egk
Go back to
Magnesium Binding Sites List in 1egk
Magnesium binding site 7 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 7 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg27
b:0.6
occ:1.00
|
O
|
A:HOH59
|
2.0
|
0.6
|
1.0
|
O
|
A:HOH55
|
2.1
|
0.6
|
1.0
|
O
|
A:HOH56
|
2.1
|
0.6
|
1.0
|
O
|
A:HOH60
|
2.1
|
0.6
|
1.0
|
O
|
A:HOH58
|
2.1
|
0.6
|
1.0
|
O
|
A:HOH57
|
2.1
|
0.6
|
1.0
|
O6
|
A:G12
|
4.1
|
58.8
|
1.0
|
O6
|
A:G13
|
4.2
|
69.3
|
1.0
|
N7
|
A:G12
|
4.3
|
58.8
|
1.0
|
N7
|
A:G13
|
4.4
|
69.3
|
1.0
|
C6
|
A:G12
|
4.7
|
58.8
|
1.0
|
C5
|
A:G12
|
4.8
|
58.8
|
1.0
|
O6
|
A:G14
|
4.9
|
56.8
|
1.0
|
|
Magnesium binding site 8 out
of 14 in 1egk
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Magnesium Binding Sites List in 1egk
Magnesium binding site 8 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 8 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg3
b:0.5
occ:1.00
|
O
|
C:HOH28
|
2.0
|
0.5
|
1.0
|
O
|
C:HOH29
|
2.1
|
0.5
|
1.0
|
O
|
B:HOH61
|
2.1
|
0.5
|
1.0
|
O
|
C:HOH32
|
2.1
|
0.5
|
1.0
|
O
|
C:HOH31
|
2.1
|
0.5
|
1.0
|
O
|
C:HOH30
|
2.1
|
0.5
|
1.0
|
O6
|
C:G105
|
4.1
|
95.0
|
1.0
|
N7
|
C:G105
|
4.2
|
95.0
|
1.0
|
N6
|
C:A104
|
4.7
|
87.3
|
1.0
|
N7
|
C:A104
|
4.8
|
87.3
|
1.0
|
C6
|
C:G105
|
4.9
|
95.0
|
1.0
|
C5
|
C:G105
|
4.9
|
95.0
|
1.0
|
|
Magnesium binding site 9 out
of 14 in 1egk
Go back to
Magnesium Binding Sites List in 1egk
Magnesium binding site 9 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 9 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg4
b:77.0
occ:1.00
|
O
|
C:HOH37
|
2.0
|
77.0
|
1.0
|
O
|
C:HOH34
|
2.0
|
77.0
|
1.0
|
O
|
C:HOH36
|
2.0
|
77.0
|
1.0
|
O
|
B:HOH63
|
2.0
|
77.0
|
1.0
|
O
|
B:HOH62
|
2.1
|
77.0
|
1.0
|
O
|
C:HOH35
|
2.1
|
77.0
|
1.0
|
O6
|
C:G102
|
4.3
|
79.2
|
1.0
|
N7
|
C:G102
|
4.3
|
79.2
|
1.0
|
N7
|
C:G103
|
4.4
|
89.0
|
1.0
|
O6
|
C:G103
|
4.6
|
89.0
|
1.0
|
OP2
|
B:DG44
|
4.7
|
87.1
|
1.0
|
O
|
C:HOH31
|
4.7
|
0.5
|
1.0
|
C6
|
C:G102
|
4.9
|
79.2
|
1.0
|
C5
|
C:G102
|
4.9
|
79.2
|
1.0
|
OP1
|
B:DG44
|
5.0
|
87.1
|
1.0
|
|
Magnesium binding site 10 out
of 14 in 1egk
Go back to
Magnesium Binding Sites List in 1egk
Magnesium binding site 10 out
of 14 in the Crystal Structure of A Nucleic Acid Four-Way Junction
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 10 of Crystal Structure of A Nucleic Acid Four-Way Junction within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg6
b:1.0
occ:1.00
|
O
|
C:HOH50
|
2.1
|
1.0
|
1.0
|
O
|
C:HOH48
|
2.1
|
1.0
|
1.0
|
O
|
C:HOH47
|
2.1
|
1.0
|
1.0
|
O
|
C:HOH45
|
2.1
|
1.0
|
1.0
|
O
|
C:HOH49
|
2.1
|
1.0
|
1.0
|
O
|
C:HOH46
|
2.1
|
1.0
|
1.0
|
O6
|
C:G113
|
3.7
|
60.2
|
1.0
|
C6
|
C:G113
|
4.7
|
60.2
|
1.0
|
N7
|
C:G112
|
4.9
|
64.4
|
1.0
|
N7
|
C:G113
|
4.9
|
60.2
|
1.0
|
|
Reference:
J.Nowakowski,
P.J.Shim,
C.D.Stout,
G.F.Joyce.
Alternative Conformations of A Nucleic Acid Four-Way Junction. J.Mol.Biol. V. 300 93 2000.
ISSN: ISSN 0022-2836
PubMed: 10864501
DOI: 10.1006/JMBI.2000.3826
Page generated: Tue Aug 13 02:57:39 2024
|