Magnesium in PDB 1ffy: Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Enzymatic activity of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
All present enzymatic activity of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin:
6.1.1.5;
Protein crystallography data
The structure of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin, PDB code: 1ffy
was solved by
L.F.Silvian,
J.Wang,
T.A.Steitz,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
10.00 /
2.20
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
71.000,
100.000,
186.000,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
23.9 /
28.1
|
Other elements in 1ffy:
The structure of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin also contains other interesting chemical elements:
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
(pdb code 1ffy). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 10 binding sites of Magnesium where determined in the
Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin, PDB code: 1ffy:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Magnesium binding site 1 out
of 10 in 1ffy
Go back to
Magnesium Binding Sites List in 1ffy
Magnesium binding site 1 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1201
b:37.5
occ:1.00
|
O
|
T:HOH1296
|
2.2
|
37.0
|
1.0
|
O
|
T:HOH1297
|
2.2
|
36.1
|
1.0
|
O
|
T:HOH1295
|
2.2
|
37.1
|
1.0
|
O
|
T:HOH1293
|
2.2
|
36.6
|
1.0
|
O
|
T:HOH1292
|
2.2
|
37.6
|
1.0
|
O
|
T:HOH1294
|
2.2
|
37.4
|
1.0
|
C5
|
T:U55
|
4.3
|
24.9
|
1.0
|
OP2
|
T:U55
|
4.3
|
33.5
|
1.0
|
OP2
|
T:A57
|
4.3
|
28.4
|
1.0
|
OP2
|
T:C56
|
4.4
|
35.2
|
1.0
|
OP1
|
T:A57
|
4.4
|
26.1
|
1.0
|
O
|
T:HOH1291
|
4.5
|
35.4
|
1.0
|
OP2
|
T:U54
|
4.5
|
39.2
|
1.0
|
C6
|
T:U55
|
4.7
|
25.4
|
1.0
|
P
|
T:A57
|
4.8
|
28.5
|
1.0
|
|
Magnesium binding site 2 out
of 10 in 1ffy
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Magnesium Binding Sites List in 1ffy
Magnesium binding site 2 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1202
b:54.3
occ:1.00
|
O
|
T:HOH1299
|
2.2
|
54.0
|
1.0
|
O
|
T:HOH1301
|
2.2
|
54.0
|
1.0
|
O
|
T:HOH1302
|
2.2
|
54.1
|
1.0
|
O
|
T:HOH1298
|
2.2
|
53.5
|
1.0
|
O
|
T:HOH1303
|
2.2
|
54.4
|
1.0
|
O
|
T:HOH1300
|
2.2
|
53.0
|
1.0
|
O
|
T:HOH1271
|
3.6
|
37.0
|
1.0
|
O
|
T:HOH1279
|
3.9
|
39.0
|
1.0
|
O
|
T:HOH1264
|
4.1
|
60.9
|
1.0
|
N7
|
T:G53
|
4.3
|
33.3
|
1.0
|
O4
|
T:U54
|
4.4
|
32.0
|
1.0
|
O4
|
T:U55
|
4.5
|
24.9
|
1.0
|
OP1
|
T:A58
|
4.5
|
28.1
|
1.0
|
OP2
|
T:A58
|
4.7
|
30.4
|
1.0
|
|
Magnesium binding site 3 out
of 10 in 1ffy
Go back to
Magnesium Binding Sites List in 1ffy
Magnesium binding site 3 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1203
b:37.2
occ:1.00
|
OP2
|
T:A14
|
2.0
|
31.5
|
1.0
|
O
|
T:HOH1306
|
2.2
|
33.8
|
1.0
|
O
|
A:HOH2198
|
2.2
|
34.8
|
1.0
|
O
|
T:HOH1304
|
2.2
|
34.5
|
1.0
|
O
|
T:HOH1305
|
2.2
|
35.5
|
1.0
|
O
|
T:HOH1307
|
2.2
|
34.5
|
1.0
|
P
|
T:A14
|
3.5
|
28.6
|
1.0
|
OD2
|
A:ASP626
|
4.2
|
27.4
|
1.0
|
O3'
|
T:C13
|
4.2
|
27.7
|
1.0
|
C3'
|
T:C13
|
4.2
|
22.6
|
1.0
|
OP1
|
T:A14
|
4.3
|
32.1
|
1.0
|
O4
|
T:U8
|
4.4
|
27.8
|
1.0
|
OP1
|
T:G7
|
4.4
|
29.7
|
1.0
|
O5'
|
T:A14
|
4.5
|
29.9
|
1.0
|
C5'
|
T:C13
|
4.5
|
20.0
|
1.0
|
O
|
T:HOH1222
|
4.8
|
18.0
|
1.0
|
C4'
|
T:C13
|
4.9
|
22.9
|
1.0
|
|
Magnesium binding site 4 out
of 10 in 1ffy
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Magnesium Binding Sites List in 1ffy
Magnesium binding site 4 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1204
b:30.7
occ:1.00
|
O
|
T:HOH1308
|
2.2
|
32.4
|
1.0
|
O
|
T:HOH1309
|
2.2
|
32.6
|
1.0
|
O
|
T:HOH1310
|
2.2
|
30.1
|
1.0
|
O
|
T:HOH1311
|
2.2
|
31.5
|
1.0
|
O6
|
T:G43
|
2.2
|
28.2
|
1.0
|
O
|
T:HOH1218
|
2.9
|
14.8
|
1.0
|
O6
|
T:G26
|
3.0
|
28.6
|
1.0
|
C6
|
T:G43
|
3.2
|
24.9
|
1.0
|
N6
|
T:A44
|
3.4
|
27.3
|
1.0
|
O
|
T:HOH1270
|
3.8
|
18.3
|
1.0
|
N4
|
T:C27
|
4.0
|
18.0
|
1.0
|
N1
|
T:G43
|
4.0
|
25.1
|
1.0
|
C5
|
T:G43
|
4.2
|
27.1
|
1.0
|
C6
|
T:G26
|
4.2
|
23.1
|
1.0
|
O
|
T:HOH1269
|
4.2
|
23.7
|
1.0
|
C6
|
T:A44
|
4.5
|
29.8
|
1.0
|
O
|
T:HOH1223
|
4.5
|
27.9
|
1.0
|
N7
|
T:G43
|
4.5
|
25.6
|
1.0
|
N7
|
T:G26
|
4.8
|
23.8
|
1.0
|
C4
|
T:C27
|
4.9
|
20.0
|
1.0
|
C5
|
T:G26
|
4.9
|
24.7
|
1.0
|
N4
|
T:C25
|
4.9
|
17.4
|
1.0
|
N3
|
T:C27
|
5.0
|
20.8
|
1.0
|
C5
|
T:C25
|
5.0
|
18.8
|
1.0
|
|
Magnesium binding site 5 out
of 10 in 1ffy
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Magnesium Binding Sites List in 1ffy
Magnesium binding site 5 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1205
b:29.0
occ:1.00
|
O
|
A:HOH2199
|
2.2
|
30.0
|
1.0
|
O
|
T:HOH1312
|
2.2
|
27.3
|
1.0
|
O
|
T:HOH1313
|
2.2
|
27.7
|
1.0
|
O
|
T:HOH1314
|
2.2
|
28.3
|
1.0
|
OP1
|
T:C25
|
2.3
|
23.0
|
1.0
|
O
|
T:HOH1233
|
3.5
|
33.1
|
1.0
|
OD1
|
A:ASN718
|
3.5
|
24.5
|
1.0
|
OD1
|
A:ASN713
|
3.6
|
25.3
|
1.0
|
P
|
T:C25
|
3.8
|
19.7
|
1.0
|
O
|
T:HOH1231
|
4.3
|
23.4
|
1.0
|
CG
|
A:ASN713
|
4.4
|
24.4
|
1.0
|
CG
|
A:ASN718
|
4.4
|
21.5
|
1.0
|
CB
|
A:ASN713
|
4.4
|
19.6
|
1.0
|
O5'
|
T:C25
|
4.4
|
16.0
|
1.0
|
ND2
|
A:ASN718
|
4.4
|
22.4
|
1.0
|
OP2
|
T:G40
|
4.6
|
21.4
|
1.0
|
O
|
T:HOH1223
|
4.6
|
27.9
|
1.0
|
OP2
|
T:C25
|
4.7
|
16.4
|
1.0
|
O3'
|
T:G24
|
4.8
|
16.2
|
1.0
|
C5'
|
T:C25
|
4.8
|
16.9
|
1.0
|
OP1
|
T:G40
|
5.0
|
21.8
|
1.0
|
CA
|
A:ASN713
|
5.0
|
17.7
|
1.0
|
|
Magnesium binding site 6 out
of 10 in 1ffy
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Magnesium Binding Sites List in 1ffy
Magnesium binding site 6 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1206
b:37.8
occ:1.00
|
OP1
|
T:U8
|
2.1
|
34.0
|
1.0
|
OP1
|
T:A9
|
2.1
|
39.0
|
1.0
|
O
|
T:HOH1318
|
2.2
|
35.4
|
1.0
|
O
|
T:HOH1315
|
2.2
|
38.9
|
1.0
|
O
|
T:HOH1316
|
2.2
|
37.1
|
1.0
|
O
|
T:HOH1317
|
2.2
|
38.1
|
1.0
|
P
|
T:U8
|
3.4
|
29.4
|
1.0
|
P
|
T:A9
|
3.5
|
40.5
|
1.0
|
O
|
T:HOH1213
|
3.7
|
46.9
|
1.0
|
MG
|
T:MG1210
|
3.8
|
36.5
|
1.0
|
O3'
|
T:G7
|
3.8
|
29.9
|
1.0
|
C5'
|
T:U8
|
3.8
|
31.7
|
1.0
|
O5'
|
T:U8
|
3.9
|
31.9
|
1.0
|
O
|
T:HOH1245
|
4.1
|
29.3
|
1.0
|
O
|
T:HOH1329
|
4.1
|
37.8
|
1.0
|
OP2
|
T:A9
|
4.2
|
39.0
|
1.0
|
O3'
|
T:U8
|
4.2
|
36.9
|
1.0
|
O2'
|
T:G7
|
4.4
|
38.5
|
1.0
|
OP2
|
T:U8
|
4.6
|
31.5
|
1.0
|
O5'
|
T:A9
|
4.6
|
41.5
|
1.0
|
O
|
T:HOH1330
|
4.6
|
36.6
|
1.0
|
C3'
|
T:U8
|
4.6
|
32.4
|
1.0
|
C4'
|
T:U8
|
4.7
|
31.5
|
1.0
|
|
Magnesium binding site 7 out
of 10 in 1ffy
Go back to
Magnesium Binding Sites List in 1ffy
Magnesium binding site 7 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 7 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1207
b:37.3
occ:1.00
|
O
|
T:HOH1319
|
2.2
|
41.8
|
1.0
|
O
|
T:HOH1320
|
2.2
|
40.7
|
1.0
|
OP2
|
T:G16
|
2.2
|
43.0
|
1.0
|
O2
|
T:U60
|
2.2
|
38.8
|
1.0
|
O6
|
T:G59
|
2.9
|
37.4
|
1.0
|
OP1
|
T:G19
|
3.0
|
41.5
|
1.0
|
O
|
T:HOH1250
|
3.0
|
41.0
|
1.0
|
C2
|
T:U60
|
3.1
|
36.3
|
1.0
|
N3
|
T:U60
|
3.3
|
35.8
|
1.0
|
C6
|
T:G59
|
3.5
|
31.6
|
1.0
|
N1
|
T:G59
|
3.6
|
31.1
|
1.0
|
P
|
T:G16
|
3.7
|
46.5
|
1.0
|
P
|
T:G19
|
3.8
|
44.2
|
1.0
|
OP2
|
T:G19
|
4.0
|
45.9
|
1.0
|
O5'
|
T:G16
|
4.2
|
53.1
|
1.0
|
O3'
|
T:G18
|
4.2
|
47.1
|
1.0
|
C5'
|
T:G16
|
4.2
|
63.0
|
1.0
|
OP2
|
T:U17
|
4.3
|
79.1
|
1.0
|
O3'
|
T:G15
|
4.4
|
42.4
|
1.0
|
N1
|
T:U60
|
4.4
|
37.0
|
1.0
|
C4
|
T:U60
|
4.6
|
36.0
|
1.0
|
O2'
|
T:G18
|
4.7
|
49.4
|
1.0
|
C5
|
T:G59
|
4.7
|
30.8
|
1.0
|
OP1
|
T:G16
|
4.7
|
46.2
|
1.0
|
C2
|
T:G59
|
4.8
|
30.9
|
1.0
|
C4'
|
T:G18
|
4.9
|
51.3
|
1.0
|
C1'
|
T:U60
|
5.0
|
37.4
|
1.0
|
|
Magnesium binding site 8 out
of 10 in 1ffy
Go back to
Magnesium Binding Sites List in 1ffy
Magnesium binding site 8 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 8 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1208
b:33.5
occ:1.00
|
O
|
T:HOH1321
|
2.2
|
35.8
|
1.0
|
O
|
A:HOH2200
|
2.2
|
35.2
|
1.0
|
O
|
T:HOH1322
|
2.2
|
32.5
|
1.0
|
O
|
A:HOH2201
|
2.2
|
36.1
|
1.0
|
OD1
|
A:ASN703
|
2.3
|
30.2
|
1.0
|
OP1
|
T:A14
|
2.3
|
32.1
|
1.0
|
P
|
T:A14
|
3.4
|
28.6
|
1.0
|
CG
|
A:ASN703
|
3.5
|
23.2
|
1.0
|
O3'
|
T:C13
|
3.6
|
27.7
|
1.0
|
O
|
A:HOH2060
|
3.6
|
30.0
|
1.0
|
O5'
|
T:A14
|
3.7
|
29.9
|
1.0
|
ND2
|
A:ASN703
|
4.1
|
27.3
|
1.0
|
CG
|
A:LEU702
|
4.5
|
21.2
|
1.0
|
CB
|
A:LEU702
|
4.6
|
19.1
|
1.0
|
N
|
A:ASN703
|
4.6
|
19.3
|
1.0
|
C5'
|
T:A14
|
4.6
|
31.6
|
1.0
|
O2'
|
T:C13
|
4.7
|
22.0
|
1.0
|
CB
|
A:ASN703
|
4.7
|
21.5
|
1.0
|
CA
|
A:ASN703
|
4.8
|
19.3
|
1.0
|
OP2
|
T:A14
|
4.8
|
31.5
|
1.0
|
CD2
|
A:LEU702
|
5.0
|
18.4
|
1.0
|
C3'
|
T:C13
|
5.0
|
22.6
|
1.0
|
|
Magnesium binding site 9 out
of 10 in 1ffy
Go back to
Magnesium Binding Sites List in 1ffy
Magnesium binding site 9 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 9 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1209
b:45.8
occ:1.00
|
O
|
T:HOH1323
|
2.2
|
46.0
|
1.0
|
O
|
T:HOH1326
|
2.2
|
44.6
|
1.0
|
O
|
T:HOH1324
|
2.2
|
45.1
|
1.0
|
OP1
|
T:G50
|
2.2
|
39.1
|
1.0
|
O
|
T:HOH1325
|
2.2
|
44.7
|
1.0
|
OP1
|
T:C48
|
3.0
|
47.9
|
1.0
|
O3'
|
T:U47
|
3.5
|
56.1
|
1.0
|
P
|
T:G50
|
3.7
|
31.2
|
1.0
|
P
|
T:C48
|
3.8
|
53.8
|
1.0
|
O5'
|
T:C48
|
4.1
|
49.9
|
1.0
|
O5'
|
T:G50
|
4.3
|
29.6
|
1.0
|
C5'
|
T:G50
|
4.3
|
30.9
|
1.0
|
C3'
|
T:U47
|
4.5
|
60.6
|
1.0
|
OP2
|
T:G50
|
4.6
|
28.4
|
1.0
|
O3'
|
T:G49
|
4.6
|
30.1
|
1.0
|
OP2
|
T:U51
|
4.7
|
38.8
|
1.0
|
C5'
|
T:C48
|
4.8
|
44.2
|
1.0
|
|
Magnesium binding site 10 out
of 10 in 1ffy
Go back to
Magnesium Binding Sites List in 1ffy
Magnesium binding site 10 out
of 10 in the Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 10 of Insights Into Editing From An Ile-Trna Synthetase Structure with Trna(Ile) and Mupirocin within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
T:Mg1210
b:36.5
occ:1.00
|
O
|
T:HOH1328
|
2.2
|
33.3
|
1.0
|
O
|
T:HOH1318
|
2.2
|
35.4
|
1.0
|
O
|
T:HOH1329
|
2.2
|
37.8
|
1.0
|
O
|
T:HOH1327
|
2.2
|
35.4
|
1.0
|
O
|
T:HOH1330
|
2.2
|
36.6
|
1.0
|
OP1
|
T:U8
|
3.3
|
34.0
|
1.0
|
OP2
|
T:U12
|
3.6
|
22.9
|
1.0
|
MG
|
T:MG1206
|
3.8
|
37.8
|
1.0
|
OP2
|
T:A9
|
3.9
|
39.0
|
1.0
|
OP2
|
T:U8
|
4.1
|
31.5
|
1.0
|
P
|
T:U8
|
4.1
|
29.4
|
1.0
|
OP1
|
T:A9
|
4.2
|
39.0
|
1.0
|
O
|
T:HOH1219
|
4.3
|
17.1
|
1.0
|
OP2
|
T:C11
|
4.3
|
20.4
|
1.0
|
O
|
T:HOH1317
|
4.4
|
38.1
|
1.0
|
O
|
T:HOH1245
|
4.6
|
29.3
|
1.0
|
P
|
T:A9
|
4.6
|
40.5
|
1.0
|
O
|
T:HOH1213
|
4.6
|
46.9
|
1.0
|
O5'
|
T:U8
|
4.9
|
31.9
|
1.0
|
P
|
T:U12
|
5.0
|
23.0
|
1.0
|
|
Reference:
L.F.Silvian,
J.Wang,
T.A.Steitz.
Insights Into Editing From An Ile-Trna Synthetase Structure with Trnaile and Mupirocin. Science V. 285 1074 1999.
ISSN: ISSN 0036-8075
PubMed: 10446055
DOI: 10.1126/SCIENCE.285.5430.1074
Page generated: Tue Aug 13 03:15:07 2024
|