Magnesium in PDB 3d2l: Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution
Protein crystallography data
The structure of Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution, PDB code: 3d2l
was solved by
Joint Center For Structural Genomics (Jcsg),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.37 /
1.90
|
Space group
|
P 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
67.830,
70.920,
77.190,
116.57,
104.63,
102.32
|
R / Rfree (%)
|
18.7 /
22.9
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution
(pdb code 3d2l). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 6 binding sites of Magnesium where determined in the
Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution, PDB code: 3d2l:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
Magnesium binding site 1 out
of 6 in 3d2l
Go back to
Magnesium Binding Sites List in 3d2l
Magnesium binding site 1 out
of 6 in the Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution
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 Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg243
b:40.4
occ:1.00
|
O
|
A:HOH416
|
1.9
|
58.7
|
1.0
|
O
|
A:HOH415
|
1.9
|
35.1
|
1.0
|
O
|
A:HOH417
|
2.0
|
31.9
|
1.0
|
O
|
A:HOH418
|
2.1
|
32.7
|
1.0
|
O
|
A:HOH419
|
2.1
|
33.4
|
1.0
|
OD1
|
A:ASP128
|
2.3
|
45.9
|
1.0
|
CG
|
A:ASP128
|
3.3
|
43.9
|
1.0
|
OD2
|
A:ASP128
|
3.5
|
52.0
|
1.0
|
O
|
A:ILE242
|
4.1
|
36.1
|
1.0
|
OE2
|
A:GLU240
|
4.1
|
38.0
|
1.0
|
O
|
A:LYS241
|
4.3
|
27.7
|
1.0
|
N
|
A:GLY129
|
4.3
|
35.4
|
1.0
|
O
|
A:HOH345
|
4.6
|
53.5
|
1.0
|
CB
|
A:ASP128
|
4.7
|
37.8
|
1.0
|
CA
|
A:GLY129
|
4.8
|
32.3
|
1.0
|
C
|
A:ASP128
|
4.8
|
35.1
|
1.0
|
C
|
A:ILE242
|
4.9
|
36.4
|
1.0
|
CA
|
A:ILE242
|
4.9
|
30.4
|
1.0
|
|
Magnesium binding site 2 out
of 6 in 3d2l
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Magnesium Binding Sites List in 3d2l
Magnesium binding site 2 out
of 6 in the Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution
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 Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg243
b:49.8
occ:1.00
|
O
|
B:HOH372
|
1.8
|
60.1
|
1.0
|
O
|
B:HOH370
|
2.1
|
35.7
|
1.0
|
O
|
B:HOH369
|
2.2
|
40.2
|
1.0
|
OD1
|
B:ASP128
|
2.2
|
41.8
|
1.0
|
O
|
B:HOH373
|
2.2
|
43.2
|
1.0
|
O
|
B:HOH371
|
2.2
|
42.5
|
1.0
|
CG
|
B:ASP128
|
3.2
|
40.1
|
1.0
|
OD2
|
B:ASP128
|
3.5
|
46.0
|
1.0
|
OXT
|
B:ILE242
|
4.0
|
37.6
|
1.0
|
OE2
|
B:GLU240
|
4.0
|
38.6
|
1.0
|
N
|
B:GLY129
|
4.3
|
34.6
|
1.0
|
O
|
B:LYS241
|
4.3
|
28.1
|
1.0
|
CB
|
B:ASP128
|
4.6
|
38.7
|
1.0
|
CA
|
B:GLY129
|
4.7
|
33.7
|
1.0
|
C
|
B:ASP128
|
4.7
|
34.9
|
1.0
|
C
|
B:ILE242
|
4.9
|
35.5
|
1.0
|
CA
|
B:ILE242
|
4.9
|
31.9
|
1.0
|
CA
|
B:ASP128
|
4.9
|
37.5
|
1.0
|
|
Magnesium binding site 3 out
of 6 in 3d2l
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Magnesium Binding Sites List in 3d2l
Magnesium binding site 3 out
of 6 in the Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution
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 Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg244
b:42.8
occ:1.00
|
O
|
B:HOH362
|
1.9
|
31.6
|
1.0
|
O
|
B:HOH374
|
2.0
|
35.0
|
1.0
|
O
|
B:HOH376
|
2.1
|
34.7
|
1.0
|
O
|
B:HOH375
|
2.1
|
37.8
|
1.0
|
O
|
D:HOH308
|
2.1
|
43.3
|
1.0
|
O
|
B:HOH377
|
2.2
|
45.4
|
1.0
|
O
|
B:HOH361
|
4.1
|
38.6
|
1.0
|
OE1
|
B:GLU211
|
4.2
|
26.9
|
1.0
|
O
|
B:HOH295
|
4.2
|
31.0
|
1.0
|
CB
|
B:GLU211
|
4.2
|
25.6
|
1.0
|
O
|
B:HOH293
|
4.2
|
37.1
|
1.0
|
OD2
|
B:ASP120
|
4.3
|
34.7
|
1.0
|
O
|
B:HOH365
|
4.3
|
54.9
|
1.0
|
OD1
|
D:ASP16
|
4.4
|
50.3
|
1.0
|
OD1
|
B:ASP120
|
4.4
|
38.6
|
1.0
|
CD
|
B:LYS116
|
4.6
|
33.9
|
1.0
|
O
|
B:GLU211
|
4.8
|
29.0
|
1.0
|
CD
|
B:GLU211
|
4.8
|
27.0
|
1.0
|
CG
|
B:ASP120
|
4.8
|
33.1
|
1.0
|
CG
|
B:GLU211
|
5.0
|
24.9
|
1.0
|
CB
|
B:LYS116
|
5.0
|
30.4
|
1.0
|
C
|
B:GLU211
|
5.0
|
27.0
|
1.0
|
|
Magnesium binding site 4 out
of 6 in 3d2l
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Magnesium Binding Sites List in 3d2l
Magnesium binding site 4 out
of 6 in the Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution
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 Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg243
b:53.5
occ:1.00
|
O
|
C:HOH338
|
1.8
|
40.8
|
1.0
|
O
|
C:HOH336
|
1.9
|
41.3
|
1.0
|
O
|
C:HOH339
|
2.1
|
49.9
|
1.0
|
OD1
|
C:ASP128
|
2.2
|
37.9
|
1.0
|
O
|
C:HOH340
|
2.2
|
44.1
|
1.0
|
O
|
C:HOH337
|
2.2
|
40.1
|
1.0
|
CG
|
C:ASP128
|
3.2
|
43.8
|
1.0
|
OD2
|
C:ASP128
|
3.5
|
46.6
|
1.0
|
OXT
|
C:ILE242
|
4.0
|
38.9
|
1.0
|
N
|
C:GLY129
|
4.1
|
34.1
|
1.0
|
OE2
|
C:GLU240
|
4.1
|
42.3
|
1.0
|
O
|
C:LYS241
|
4.2
|
33.1
|
1.0
|
CA
|
C:GLY129
|
4.5
|
33.2
|
1.0
|
CB
|
C:ASP128
|
4.5
|
37.4
|
1.0
|
C
|
C:ASP128
|
4.6
|
35.1
|
1.0
|
C
|
C:ILE242
|
4.8
|
37.4
|
1.0
|
CA
|
C:ASP128
|
4.8
|
37.3
|
1.0
|
CA
|
C:ILE242
|
4.8
|
34.6
|
1.0
|
O
|
C:HOH304
|
4.8
|
53.9
|
1.0
|
|
Magnesium binding site 5 out
of 6 in 3d2l
Go back to
Magnesium Binding Sites List in 3d2l
Magnesium binding site 5 out
of 6 in the Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution
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 Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg243
b:28.3
occ:1.00
|
O
|
A:HOH420
|
1.9
|
41.1
|
1.0
|
O
|
D:HOH343
|
2.0
|
34.1
|
1.0
|
O
|
D:HOH344
|
2.0
|
36.0
|
1.0
|
O
|
D:HOH342
|
2.2
|
38.3
|
1.0
|
O
|
A:HOH422
|
2.2
|
40.5
|
1.0
|
O
|
A:HOH421
|
2.2
|
38.3
|
1.0
|
O
|
D:ALA212
|
4.1
|
27.9
|
1.0
|
O
|
A:HOH317
|
4.2
|
20.4
|
1.0
|
OD1
|
D:ASP120
|
4.2
|
33.9
|
1.0
|
O
|
D:HOH248
|
4.2
|
23.2
|
1.0
|
OD1
|
A:ASP120
|
4.3
|
26.6
|
1.0
|
C
|
D:ALA212
|
4.3
|
29.0
|
1.0
|
O
|
D:GLU211
|
4.3
|
30.5
|
1.0
|
O
|
A:GLU211
|
4.4
|
26.0
|
1.0
|
O
|
A:ALA212
|
4.4
|
25.9
|
1.0
|
CA
|
D:ALA212
|
4.6
|
30.0
|
1.0
|
C
|
A:ALA212
|
4.6
|
27.6
|
1.0
|
O
|
D:HOH306
|
4.6
|
33.5
|
1.0
|
CA
|
A:ALA212
|
4.8
|
28.4
|
1.0
|
CG
|
D:ASP120
|
4.8
|
29.9
|
1.0
|
CG
|
A:ASP120
|
4.9
|
27.2
|
1.0
|
N
|
D:GLY213
|
4.9
|
30.4
|
1.0
|
|
Magnesium binding site 6 out
of 6 in 3d2l
Go back to
Magnesium Binding Sites List in 3d2l
Magnesium binding site 6 out
of 6 in the Crystal Structure of Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution
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 Sam-Dependent Methyltransferase (ZP_00538691.1) From Exiguobacterium Sp. 255-15 at 1.90 A Resolution within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg244
b:58.0
occ:1.00
|
O
|
A:HOH424
|
1.9
|
47.0
|
1.0
|
OD1
|
D:ASP114
|
2.1
|
32.9
|
1.0
|
O
|
A:HOH425
|
2.1
|
43.1
|
1.0
|
O
|
D:HOH345
|
2.4
|
40.1
|
1.0
|
O
|
A:HOH423
|
2.4
|
41.6
|
1.0
|
O
|
D:HOH346
|
2.6
|
48.8
|
1.0
|
CG
|
D:ASP114
|
3.0
|
28.5
|
1.0
|
OD2
|
D:ASP114
|
3.2
|
36.6
|
1.0
|
OG1
|
D:THR111
|
3.8
|
29.6
|
1.0
|
OE2
|
A:GLU91
|
3.9
|
43.5
|
1.0
|
OE1
|
A:GLU91
|
3.9
|
53.3
|
1.0
|
CD
|
A:GLU91
|
4.3
|
47.1
|
1.0
|
CB
|
D:ASP114
|
4.4
|
22.7
|
1.0
|
CD
|
D:ARG88
|
4.6
|
35.6
|
1.0
|
N
|
D:ASP114
|
4.7
|
24.7
|
1.0
|
CA
|
D:ASP114
|
4.8
|
24.0
|
1.0
|
O
|
D:HOH289
|
4.8
|
44.9
|
1.0
|
CG2
|
D:THR111
|
4.8
|
30.9
|
1.0
|
CB
|
D:THR111
|
4.9
|
28.1
|
1.0
|
NE2
|
D:GLN117
|
4.9
|
39.3
|
1.0
|
NE
|
D:ARG88
|
5.0
|
45.2
|
1.0
|
|
Reference:
Joint Center For Structural Genomics (Jcsg),
Joint Center For Structural Genomics (Jcsg).
N/A N/A.
Page generated: Wed Aug 14 12:20:00 2024
|