Magnesium in PDB 3igi: Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
Protein crystallography data
The structure of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron, PDB code: 3igi
was solved by
N.Toor,
K.S.Keating,
O.Fedorova,
K.Rajashankar,
J.Wang,
A.M.Pyle,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
43.70 /
3.12
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
89.092,
94.969,
225.972,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
18.3 /
21.8
|
Other elements in 3igi:
The structure of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron also contains other interesting chemical elements:
Magnesium Binding Sites:
Magnesium binding site 1 out
of 44 in 3igi
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Magnesium Binding Sites List in 3igi
Magnesium binding site 1 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg413
b:57.0
occ:1.00
|
O3'
|
B:U6
|
2.2
|
0.8
|
1.0
|
OP1
|
A:U375
|
2.2
|
83.2
|
1.0
|
OP2
|
A:C377
|
2.3
|
76.5
|
1.0
|
O2'
|
B:U6
|
2.9
|
0.1
|
1.0
|
OP1
|
B:A7
|
3.1
|
84.6
|
1.0
|
P
|
A:U375
|
3.1
|
66.2
|
1.0
|
C3'
|
B:U6
|
3.1
|
0.1
|
1.0
|
P
|
B:A7
|
3.2
|
0.1
|
1.0
|
C4'
|
B:U6
|
3.4
|
0.9
|
1.0
|
O3'
|
A:G374
|
3.4
|
78.4
|
1.0
|
P
|
A:C377
|
3.5
|
74.1
|
1.0
|
OP2
|
A:U375
|
3.5
|
56.3
|
1.0
|
C2'
|
B:U6
|
3.5
|
0.7
|
1.0
|
OP1
|
A:G359
|
3.9
|
68.8
|
1.0
|
OP1
|
A:C377
|
4.0
|
72.5
|
1.0
|
O5'
|
A:C377
|
4.0
|
56.2
|
1.0
|
OP2
|
B:A7
|
4.2
|
0.9
|
1.0
|
O5'
|
B:A7
|
4.3
|
0.6
|
1.0
|
O4'
|
B:U6
|
4.4
|
88.4
|
1.0
|
C5'
|
B:U6
|
4.4
|
0.4
|
1.0
|
OP2
|
A:G359
|
4.5
|
65.5
|
1.0
|
O5'
|
A:U375
|
4.5
|
66.0
|
1.0
|
C5'
|
B:A7
|
4.6
|
0.5
|
1.0
|
C1'
|
B:U6
|
4.6
|
0.4
|
1.0
|
MG
|
A:MG414
|
4.6
|
71.9
|
1.0
|
C3'
|
A:G374
|
4.6
|
76.2
|
1.0
|
C5'
|
A:C377
|
4.7
|
59.2
|
1.0
|
P
|
A:G359
|
4.7
|
75.9
|
1.0
|
O3'
|
A:A376
|
4.8
|
54.5
|
1.0
|
C5'
|
A:G374
|
5.0
|
78.7
|
1.0
|
|
Magnesium binding site 2 out
of 44 in 3igi
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Magnesium Binding Sites List in 3igi
Magnesium binding site 2 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg414
b:71.9
occ:1.00
|
OP1
|
B:A7
|
2.2
|
84.6
|
1.0
|
OP1
|
A:C358
|
2.3
|
90.9
|
1.0
|
OP1
|
A:C377
|
2.3
|
72.5
|
1.0
|
OP2
|
B:A7
|
2.7
|
0.9
|
1.0
|
P
|
B:A7
|
2.8
|
0.1
|
1.0
|
OP2
|
A:G359
|
3.0
|
65.5
|
1.0
|
P
|
A:C377
|
3.6
|
74.1
|
1.0
|
P
|
A:C358
|
3.7
|
77.5
|
1.0
|
O5'
|
B:A7
|
3.9
|
0.6
|
1.0
|
OP2
|
A:C377
|
4.1
|
76.5
|
1.0
|
O3'
|
B:U6
|
4.1
|
0.8
|
1.0
|
P
|
A:G359
|
4.4
|
75.9
|
1.0
|
O5'
|
A:C358
|
4.4
|
62.9
|
1.0
|
O3'
|
A:A376
|
4.4
|
54.5
|
1.0
|
C5'
|
A:C358
|
4.5
|
63.6
|
1.0
|
C5'
|
B:A7
|
4.6
|
0.5
|
1.0
|
O3'
|
A:C357
|
4.6
|
90.8
|
1.0
|
MG
|
A:MG413
|
4.6
|
57.0
|
1.0
|
OP2
|
A:C358
|
4.7
|
89.8
|
1.0
|
O5'
|
A:C377
|
4.7
|
56.2
|
1.0
|
OP1
|
A:G359
|
5.0
|
68.8
|
1.0
|
|
Magnesium binding site 3 out
of 44 in 3igi
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Magnesium Binding Sites List in 3igi
Magnesium binding site 3 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg415
b:84.9
occ:1.00
|
OP2
|
A:U4
|
2.6
|
84.5
|
1.0
|
O
|
A:HOH533
|
2.7
|
79.8
|
1.0
|
O
|
A:HOH565
|
3.4
|
86.8
|
1.0
|
OP1
|
A:G3
|
3.5
|
0.5
|
1.0
|
P
|
A:U4
|
4.0
|
76.5
|
1.0
|
OP1
|
A:U4
|
4.5
|
88.0
|
1.0
|
O3'
|
A:G3
|
4.7
|
56.0
|
1.0
|
P
|
A:G3
|
4.7
|
0.6
|
1.0
|
O5'
|
A:G3
|
4.8
|
83.8
|
1.0
|
|
Magnesium binding site 4 out
of 44 in 3igi
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Magnesium Binding Sites List in 3igi
Magnesium binding site 4 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg416
b:91.6
occ:1.00
|
O6
|
A:G15
|
2.8
|
98.8
|
1.0
|
O4
|
A:U256
|
3.2
|
0.9
|
1.0
|
O6
|
A:G14
|
3.7
|
99.4
|
1.0
|
C6
|
A:G15
|
4.0
|
88.9
|
1.0
|
O4
|
A:U255
|
4.0
|
0.0
|
1.0
|
C4
|
A:U256
|
4.3
|
0.4
|
1.0
|
C6
|
A:G14
|
4.5
|
82.5
|
1.0
|
N3
|
A:U256
|
4.5
|
1.0
|
1.0
|
N7
|
A:G15
|
4.6
|
83.6
|
1.0
|
C5
|
A:G15
|
4.7
|
83.5
|
1.0
|
O6
|
A:G16
|
4.8
|
97.4
|
1.0
|
|
Magnesium binding site 5 out
of 44 in 3igi
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Magnesium Binding Sites List in 3igi
Magnesium binding site 5 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg417
b:75.0
occ:1.00
|
O6
|
A:G244
|
3.6
|
0.8
|
1.0
|
O6
|
A:G243
|
3.8
|
91.0
|
1.0
|
O6
|
A:G242
|
4.0
|
0.2
|
1.0
|
N7
|
A:G243
|
4.1
|
84.9
|
1.0
|
N7
|
A:G242
|
4.2
|
85.5
|
1.0
|
C6
|
A:G244
|
4.5
|
93.0
|
1.0
|
O
|
A:HOH546
|
4.5
|
84.5
|
1.0
|
C6
|
A:G242
|
4.6
|
96.9
|
1.0
|
C6
|
A:G243
|
4.6
|
90.6
|
1.0
|
C5
|
A:G242
|
4.6
|
82.3
|
1.0
|
C5
|
A:G243
|
4.8
|
88.4
|
1.0
|
|
Magnesium binding site 6 out
of 44 in 3igi
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Magnesium Binding Sites List in 3igi
Magnesium binding site 6 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg418
b:91.5
occ:1.00
|
O
|
A:HOH546
|
2.6
|
84.5
|
1.0
|
OP1
|
A:C39
|
4.0
|
90.4
|
1.0
|
OP2
|
A:G243
|
4.3
|
0.4
|
1.0
|
O3'
|
A:C38
|
4.5
|
72.2
|
1.0
|
OP1
|
A:C38
|
4.7
|
56.9
|
1.0
|
P
|
A:C39
|
4.8
|
86.6
|
1.0
|
O6
|
A:G244
|
4.8
|
0.8
|
1.0
|
C5'
|
A:C38
|
5.0
|
72.4
|
1.0
|
|
Magnesium binding site 7 out
of 44 in 3igi
Go back to
Magnesium Binding Sites List in 3igi
Magnesium binding site 7 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 7 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg419
b:0.3
occ:1.00
|
O6
|
A:G385
|
2.9
|
77.6
|
1.0
|
O6
|
A:G386
|
3.1
|
90.0
|
1.0
|
MG
|
A:MG421
|
3.4
|
99.2
|
1.0
|
C6
|
A:G385
|
3.7
|
75.3
|
1.0
|
N7
|
A:G385
|
3.8
|
90.2
|
1.0
|
C5
|
A:G385
|
4.0
|
83.1
|
1.0
|
C6
|
A:G386
|
4.0
|
90.4
|
1.0
|
N7
|
A:G386
|
4.2
|
86.8
|
1.0
|
O2
|
A:C289
|
4.4
|
95.5
|
1.0
|
C5
|
A:G386
|
4.5
|
89.4
|
1.0
|
N4
|
A:C358
|
4.5
|
65.2
|
1.0
|
N1
|
A:G385
|
4.8
|
73.5
|
1.0
|
N4
|
A:C357
|
4.9
|
80.8
|
1.0
|
C8
|
A:G385
|
4.9
|
91.0
|
1.0
|
O6
|
A:G359
|
4.9
|
90.6
|
1.0
|
|
Magnesium binding site 8 out
of 44 in 3igi
Go back to
Magnesium Binding Sites List in 3igi
Magnesium binding site 8 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 8 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg420
b:84.2
occ:1.00
|
O
|
A:HOH501
|
2.5
|
88.3
|
1.0
|
OP1
|
A:G135
|
3.8
|
76.6
|
1.0
|
OP1
|
A:G373
|
3.9
|
66.9
|
1.0
|
O3'
|
A:A134
|
4.3
|
69.9
|
1.0
|
OP1
|
A:U132
|
4.4
|
74.7
|
1.0
|
OP1
|
A:G133
|
4.6
|
73.9
|
1.0
|
P
|
A:G135
|
4.7
|
85.8
|
1.0
|
P
|
A:G373
|
4.9
|
72.2
|
1.0
|
OP2
|
A:G133
|
4.9
|
62.3
|
1.0
|
O2'
|
A:A134
|
4.9
|
94.7
|
1.0
|
|
Magnesium binding site 9 out
of 44 in 3igi
Go back to
Magnesium Binding Sites List in 3igi
Magnesium binding site 9 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 9 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg421
b:99.2
occ:1.00
|
OP2
|
A:A290
|
3.0
|
69.2
|
1.0
|
O6
|
A:G386
|
3.2
|
90.0
|
1.0
|
MG
|
A:MG419
|
3.4
|
0.3
|
1.0
|
O4
|
A:U387
|
3.7
|
79.5
|
1.0
|
C6
|
A:G386
|
4.1
|
90.4
|
1.0
|
N7
|
A:G386
|
4.3
|
86.8
|
1.0
|
P
|
A:A290
|
4.3
|
87.1
|
1.0
|
C5
|
A:G386
|
4.5
|
89.4
|
1.0
|
O6
|
A:G388
|
4.7
|
96.4
|
1.0
|
O5'
|
A:A290
|
4.7
|
91.3
|
1.0
|
O3'
|
A:C289
|
4.8
|
89.7
|
1.0
|
C5'
|
A:A290
|
4.8
|
85.1
|
1.0
|
C4
|
A:U387
|
4.8
|
73.2
|
1.0
|
N4
|
A:C357
|
4.8
|
80.8
|
1.0
|
O2'
|
A:C289
|
4.9
|
81.8
|
1.0
|
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Magnesium binding site 10 out
of 44 in 3igi
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Magnesium Binding Sites List in 3igi
Magnesium binding site 10 out
of 44 in the Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron
 Mono view
 Stereo pair view
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A full contact list of Magnesium with other atoms in the Mg binding
site number 10 of Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg422
b:86.6
occ:1.00
|
OP2
|
A:G374
|
2.5
|
64.7
|
1.0
|
O
|
A:HOH536
|
2.8
|
74.1
|
1.0
|
OP1
|
A:C360
|
3.0
|
81.5
|
1.0
|
OP2
|
A:G373
|
3.7
|
76.4
|
1.0
|
P
|
A:G374
|
4.0
|
76.3
|
1.0
|
O5'
|
A:G373
|
4.1
|
51.8
|
1.0
|
P
|
A:G373
|
4.2
|
72.2
|
1.0
|
OP1
|
A:G373
|
4.3
|
66.9
|
1.0
|
P
|
A:C360
|
4.4
|
79.7
|
1.0
|
C3'
|
A:G373
|
4.5
|
57.9
|
1.0
|
O3'
|
A:G373
|
4.5
|
54.6
|
1.0
|
OP1
|
A:G374
|
4.9
|
85.1
|
1.0
|
O5'
|
A:G374
|
4.9
|
78.8
|
1.0
|
O5'
|
A:C360
|
4.9
|
77.8
|
1.0
|
C5'
|
A:G374
|
5.0
|
78.7
|
1.0
|
C8
|
A:G374
|
5.0
|
62.6
|
1.0
|
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Reference:
N.Toor,
K.S.Keating,
O.Fedorova,
K.Rajashankar,
J.Wang,
A.M.Pyle.
Tertiary Architecture of the Oceanobacillus Iheyensis Group II Intron. Rna V. 16 57 2010.
ISSN: ISSN 1355-8382
PubMed: 19952115
DOI: 10.1261/RNA.1844010
Page generated: Wed Aug 14 16:07:52 2024
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