Magnesium in PDB 8joz: Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
Protein crystallography data
The structure of Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser, PDB code: 8joz
was solved by
J.Yoo,
J.Kim,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
40.74 /
2.22
|
Space group
|
P 61 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
65.614,
65.614,
584.532,
90,
90,
120
|
R / Rfree (%)
|
19.9 /
22.5
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
(pdb code 8joz). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 7 binding sites of Magnesium where determined in the
Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser, PDB code: 8joz:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
7;
Magnesium binding site 1 out
of 7 in 8joz
Go back to
Magnesium Binding Sites List in 8joz
Magnesium binding site 1 out
of 7 in the Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
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 Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg101
b:35.1
occ:1.00
|
O
|
B:HOH379
|
2.0
|
32.4
|
1.0
|
O
|
B:HOH333
|
2.0
|
31.7
|
1.0
|
O
|
B:HOH380
|
2.1
|
32.7
|
1.0
|
O
|
B:HOH246
|
2.1
|
32.0
|
1.0
|
O
|
B:HOH306
|
2.1
|
33.2
|
1.0
|
O
|
B:HOH375
|
2.3
|
33.3
|
1.0
|
O
|
B:HOH280
|
3.7
|
35.1
|
1.0
|
O
|
B:HOH355
|
4.0
|
41.0
|
1.0
|
N7
|
B:G23
|
4.2
|
31.6
|
1.0
|
O
|
B:HOH398
|
4.2
|
41.3
|
1.0
|
O
|
B:HOH255
|
4.2
|
33.1
|
1.0
|
N7
|
B:G24
|
4.3
|
37.8
|
1.0
|
O6
|
B:G23
|
4.4
|
34.2
|
1.0
|
O
|
B:HOH397
|
4.4
|
37.6
|
1.0
|
O
|
B:HOH259
|
4.4
|
36.1
|
1.0
|
N4
|
B:C44
|
4.4
|
38.4
|
1.0
|
O6
|
B:G24
|
4.5
|
40.8
|
1.0
|
OP2
|
B:A22
|
4.6
|
30.7
|
1.0
|
C5
|
B:G23
|
4.8
|
33.2
|
1.0
|
C6
|
B:G23
|
4.8
|
34.0
|
1.0
|
N4
|
B:C25
|
4.9
|
41.0
|
1.0
|
OP2
|
B:G23
|
4.9
|
36.8
|
1.0
|
|
Magnesium binding site 2 out
of 7 in 8joz
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Magnesium Binding Sites List in 8joz
Magnesium binding site 2 out
of 7 in the Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
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 Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg102
b:49.0
occ:1.00
|
O
|
B:HOH277
|
1.9
|
35.8
|
1.0
|
O
|
B:HOH402
|
2.0
|
42.5
|
1.0
|
O
|
B:HOH405
|
2.1
|
43.0
|
1.0
|
O
|
B:HOH400
|
2.2
|
39.3
|
1.0
|
O
|
B:HOH245
|
2.2
|
39.6
|
1.0
|
O
|
B:HOH298
|
2.3
|
38.6
|
1.0
|
O
|
B:HOH232
|
3.8
|
37.8
|
1.0
|
O
|
B:HOH263
|
4.1
|
38.8
|
1.0
|
N7
|
B:G42
|
4.2
|
37.3
|
1.0
|
O
|
B:HOH330
|
4.2
|
40.2
|
1.0
|
O
|
B:HOH372
|
4.3
|
44.7
|
1.0
|
O
|
B:HOH355
|
4.4
|
41.0
|
1.0
|
O6
|
B:G43
|
4.4
|
40.5
|
1.0
|
N7
|
B:G43
|
4.6
|
39.0
|
1.0
|
O6
|
B:G42
|
4.6
|
37.6
|
1.0
|
C5
|
B:G42
|
5.0
|
35.7
|
1.0
|
|
Magnesium binding site 3 out
of 7 in 8joz
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Magnesium Binding Sites List in 8joz
Magnesium binding site 3 out
of 7 in the Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
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 Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg103
b:46.7
occ:1.00
|
O
|
B:HOH404
|
1.9
|
47.5
|
1.0
|
O
|
B:HOH300
|
2.1
|
44.0
|
1.0
|
O
|
B:HOH226
|
2.1
|
43.3
|
1.0
|
O
|
B:HOH315
|
2.2
|
53.5
|
1.0
|
O
|
B:HOH295
|
2.2
|
41.5
|
1.0
|
O
|
B:HOH231
|
2.3
|
45.9
|
1.0
|
O
|
B:HOH207
|
4.3
|
39.2
|
1.0
|
O6
|
B:G53
|
4.3
|
56.9
|
1.0
|
O2'
|
B:A58
|
4.3
|
45.4
|
1.0
|
O
|
B:HOH324
|
4.4
|
53.0
|
1.0
|
O
|
B:HOH354
|
4.4
|
44.1
|
1.0
|
OP1
|
B:A58
|
4.4
|
43.3
|
1.0
|
OP1
|
B:U47K
|
4.5
|
41.9
|
1.0
|
O4
|
B:5MU54
|
4.5
|
62.1
|
1.0
|
C2'
|
B:A58
|
4.7
|
47.4
|
1.0
|
N7
|
B:G53
|
4.7
|
59.4
|
1.0
|
OP2
|
B:A58
|
4.8
|
60.0
|
1.0
|
|
Magnesium binding site 4 out
of 7 in 8joz
Go back to
Magnesium Binding Sites List in 8joz
Magnesium binding site 4 out
of 7 in the Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
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 Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg104
b:50.0
occ:1.00
|
O
|
B:HOH229
|
1.9
|
42.3
|
1.0
|
O
|
B:HOH273
|
2.0
|
37.0
|
1.0
|
O
|
B:HOH224
|
2.1
|
41.0
|
1.0
|
O
|
B:HOH219
|
2.1
|
37.5
|
1.0
|
O
|
B:HOH307
|
2.1
|
41.1
|
1.0
|
O
|
B:HOH251
|
2.3
|
41.4
|
1.0
|
OP2
|
B:G9
|
3.6
|
43.2
|
1.0
|
OP2
|
B:C12
|
3.7
|
41.7
|
1.0
|
O
|
B:HOH257
|
3.9
|
42.1
|
1.0
|
N7
|
B:G13
|
4.2
|
37.4
|
1.0
|
OP1
|
B:4SU8
|
4.3
|
45.5
|
1.0
|
OP2
|
B:4SU8
|
4.3
|
50.9
|
1.0
|
O
|
B:HOH310
|
4.5
|
46.5
|
1.0
|
C5'
|
B:C12
|
4.5
|
40.0
|
1.0
|
OP2
|
B:G13
|
4.7
|
39.6
|
1.0
|
O6
|
B:G13
|
4.8
|
37.3
|
1.0
|
P
|
B:4SU8
|
4.8
|
43.5
|
1.0
|
C6
|
B:C12
|
4.9
|
39.3
|
1.0
|
|
Magnesium binding site 5 out
of 7 in 8joz
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Magnesium Binding Sites List in 8joz
Magnesium binding site 5 out
of 7 in the Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
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 Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg105
b:39.6
occ:1.00
|
O
|
B:HOH265
|
1.9
|
36.8
|
1.0
|
O
|
B:HOH321
|
2.0
|
37.1
|
1.0
|
O
|
B:HOH264
|
2.1
|
39.5
|
1.0
|
OP1
|
B:C48
|
2.1
|
39.8
|
1.0
|
O
|
B:HOH368
|
2.2
|
37.6
|
1.0
|
O
|
B:HOH358
|
2.3
|
40.8
|
1.0
|
P
|
B:C48
|
3.4
|
36.0
|
1.0
|
O
|
B:HOH210
|
3.6
|
40.0
|
1.0
|
O3'
|
B:U47K
|
3.6
|
33.2
|
1.0
|
OP2
|
B:A50
|
3.7
|
45.0
|
1.0
|
O
|
B:HOH261
|
3.9
|
40.0
|
1.0
|
O
|
B:HOH240
|
3.9
|
37.7
|
1.0
|
O
|
B:HOH312
|
4.1
|
42.9
|
1.0
|
OP2
|
B:C48
|
4.2
|
34.3
|
1.0
|
O
|
B:HOH327
|
4.3
|
40.5
|
1.0
|
O
|
B:HOH222
|
4.3
|
45.5
|
1.0
|
N7
|
B:G51
|
4.4
|
44.8
|
1.0
|
N7
|
B:A50
|
4.4
|
43.5
|
1.0
|
OP1
|
B:C49
|
4.4
|
33.4
|
1.0
|
O
|
B:HOH329
|
4.5
|
44.6
|
1.0
|
O5'
|
B:C48
|
4.6
|
34.8
|
1.0
|
OP2
|
B:G51
|
4.6
|
44.8
|
1.0
|
C8
|
B:A50
|
4.7
|
42.7
|
1.0
|
C5'
|
B:C48
|
4.9
|
35.4
|
1.0
|
C3'
|
B:C48
|
4.9
|
35.0
|
1.0
|
C3'
|
B:U47K
|
4.9
|
35.0
|
1.0
|
P
|
B:A50
|
5.0
|
38.2
|
1.0
|
O5'
|
B:A50
|
5.0
|
43.4
|
1.0
|
|
Magnesium binding site 6 out
of 7 in 8joz
Go back to
Magnesium Binding Sites List in 8joz
Magnesium binding site 6 out
of 7 in the Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
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 Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg106
b:39.3
occ:1.00
|
O
|
B:HOH341
|
2.0
|
35.8
|
1.0
|
O
|
B:HOH253
|
2.0
|
33.5
|
1.0
|
O
|
B:HOH214
|
2.2
|
29.4
|
1.0
|
O
|
B:HOH281
|
2.2
|
35.5
|
1.0
|
O
|
B:HOH344
|
2.3
|
34.6
|
1.0
|
O
|
B:HOH384
|
2.5
|
38.8
|
1.0
|
OP1
|
B:G45
|
4.0
|
41.9
|
1.0
|
N7
|
B:G45
|
4.1
|
35.4
|
1.0
|
O
|
B:HOH299
|
4.2
|
35.6
|
1.0
|
O2'
|
B:G20B
|
4.3
|
36.8
|
1.0
|
OP2
|
B:G45
|
4.3
|
44.8
|
1.0
|
OP2
|
B:A21
|
4.4
|
36.7
|
1.0
|
O
|
B:HOH247
|
4.4
|
42.2
|
1.0
|
O
|
B:HOH272
|
4.5
|
38.8
|
1.0
|
C8
|
B:G45
|
4.6
|
37.8
|
1.0
|
O3'
|
B:G20B
|
4.6
|
33.9
|
1.0
|
O
|
B:HOH335
|
4.6
|
40.9
|
1.0
|
O
|
B:HOH211
|
4.7
|
46.2
|
1.0
|
N2
|
B:G9
|
4.7
|
34.0
|
1.0
|
P
|
B:G45
|
4.7
|
40.5
|
1.0
|
N3
|
B:G20B
|
4.8
|
34.7
|
1.0
|
|
Magnesium binding site 7 out
of 7 in 8joz
Go back to
Magnesium Binding Sites List in 8joz
Magnesium binding site 7 out
of 7 in the Crystal Structure of Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser
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 Cmom From E. Coli Complexed with Sinefungin and Cellularly Expressed Trna Ser within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg107
b:42.4
occ:1.00
|
O
|
B:HOH302
|
1.9
|
41.5
|
1.0
|
O
|
B:HOH244
|
2.0
|
47.6
|
1.0
|
OP1
|
B:A59
|
2.0
|
40.4
|
1.0
|
O
|
B:HOH360
|
2.1
|
51.5
|
1.0
|
O
|
B:HOH266
|
2.1
|
42.6
|
1.0
|
O
|
B:HOH340
|
2.2
|
47.7
|
1.0
|
P
|
B:A59
|
3.4
|
41.0
|
1.0
|
O
|
B:HOH387
|
3.9
|
44.9
|
1.0
|
OP2
|
B:A59
|
4.0
|
37.4
|
1.0
|
OP2
|
B:G20B
|
4.1
|
46.1
|
1.0
|
O
|
B:HOH386
|
4.2
|
46.7
|
1.0
|
C4'
|
B:A58
|
4.2
|
44.6
|
1.0
|
O3'
|
B:A58
|
4.3
|
45.7
|
1.0
|
O2'
|
B:H2U20A
|
4.4
|
41.4
|
1.0
|
O5'
|
B:A59
|
4.4
|
38.3
|
1.0
|
OP2
|
B:H2U20
|
4.5
|
49.2
|
1.0
|
N7
|
B:A59
|
4.5
|
36.0
|
1.0
|
O4
|
B:U60
|
4.5
|
43.1
|
1.0
|
OP1
|
B:H2U20
|
4.5
|
42.9
|
1.0
|
C5'
|
B:A58
|
4.6
|
48.8
|
1.0
|
O3'
|
B:H2U20A
|
4.7
|
44.5
|
1.0
|
C3'
|
B:A58
|
4.7
|
45.2
|
1.0
|
C8
|
B:A59
|
4.8
|
37.5
|
1.0
|
|
Reference:
J.Yoo,
J.Lee,
J.Kim.
Structural Basis For the Selective Methylation of 5-Carboxymethoxyuridine in Trna Modification. Nucleic Acids Res. 2023.
ISSN: ESSN 1362-4962
PubMed: 37587716
DOI: 10.1093/NAR/GKAD668
Page generated: Fri Oct 4 13:14:26 2024
|