Magnesium in PDB 3fvb: Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis
Protein crystallography data
The structure of Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis, PDB code: 3fvb
was solved by
Seattle Structural Genomics Center For Infectious Disease (Ssgcid),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
50.00 /
1.81
|
Space group
|
F 2 3
|
Cell size a, b, c (Å), α, β, γ (°)
|
174.810,
174.810,
174.810,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
18.1 /
21.5
|
Other elements in 3fvb:
The structure of Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis also contains other interesting chemical elements:
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis
(pdb code 3fvb). 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 Ferritin (Bacterioferritin) From Brucella Melitensis, PDB code: 3fvb:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
Magnesium binding site 1 out
of 6 in 3fvb
Go back to
Magnesium Binding Sites List in 3fvb
Magnesium binding site 1 out
of 6 in the Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis
 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 Ferritin (Bacterioferritin) From Brucella Melitensis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg165
b:34.4
occ:1.00
|
O
|
A:HOH201
|
2.0
|
37.5
|
1.0
|
O
|
A:HOH200
|
2.0
|
32.8
|
1.0
|
O
|
A:HOH197
|
2.1
|
37.1
|
1.0
|
O
|
A:HOH199
|
2.2
|
34.4
|
1.0
|
O
|
A:HOH198
|
2.2
|
38.3
|
1.0
|
O
|
A:HOH202
|
2.2
|
34.1
|
1.0
|
O
|
A:HOH323
|
4.2
|
37.2
|
1.0
|
O
|
A:HOH203
|
4.3
|
42.8
|
1.0
|
O
|
A:HOH348
|
4.5
|
35.4
|
1.0
|
OD2
|
A:ASP132
|
4.7
|
29.6
|
1.0
|
O
|
A:HOH288
|
4.9
|
40.9
|
1.0
|
O
|
A:HOH322
|
5.0
|
41.0
|
1.0
|
|
Magnesium binding site 2 out
of 6 in 3fvb
Go back to
Magnesium Binding Sites List in 3fvb
Magnesium binding site 2 out
of 6 in the Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis
 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 Ferritin (Bacterioferritin) From Brucella Melitensis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg166
b:36.9
occ:1.00
|
OD1
|
A:ASP34
|
2.0
|
21.8
|
1.0
|
O
|
A:HOH206
|
2.1
|
32.0
|
1.0
|
O
|
B:HOH208
|
2.1
|
25.7
|
1.0
|
O
|
A:HOH205
|
2.2
|
40.1
|
1.0
|
O
|
A:HOH207
|
2.2
|
33.6
|
1.0
|
CG
|
A:ASP34
|
3.0
|
25.1
|
1.0
|
O
|
A:HOH209
|
3.2
|
25.2
|
1.0
|
OD2
|
A:ASP34
|
3.3
|
30.3
|
1.0
|
O
|
A:ASP34
|
4.1
|
21.0
|
1.0
|
O
|
A:HOH304
|
4.2
|
33.6
|
1.0
|
O
|
B:HOH171
|
4.3
|
35.0
|
1.0
|
O
|
A:HOH248
|
4.3
|
58.4
|
1.0
|
CB
|
A:ASP34
|
4.4
|
21.7
|
1.0
|
O
|
B:ILE63
|
4.6
|
21.6
|
1.0
|
O
|
B:HOH312
|
4.6
|
37.5
|
1.0
|
O
|
A:HOH247
|
4.7
|
47.4
|
1.0
|
C
|
A:ASP34
|
4.8
|
21.4
|
1.0
|
CA
|
A:ASP34
|
4.9
|
21.2
|
1.0
|
|
Magnesium binding site 3 out
of 6 in 3fvb
Go back to
Magnesium Binding Sites List in 3fvb
Magnesium binding site 3 out
of 6 in the Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis
 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 Ferritin (Bacterioferritin) From Brucella Melitensis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg167
b:57.5
occ:0.33
|
O
|
A:HOH320
|
2.1
|
41.2
|
1.0
|
O
|
A:HOH373
|
2.3
|
50.5
|
1.0
|
OD2
|
A:ASP109
|
3.6
|
33.7
|
1.0
|
O
|
A:HOH340
|
3.9
|
39.7
|
1.0
|
OD1
|
A:ASP109
|
4.1
|
29.3
|
1.0
|
CG
|
A:ASP109
|
4.2
|
29.8
|
1.0
|
CL
|
A:CL169
|
4.7
|
34.5
|
0.3
|
NH1
|
A:ARG105
|
4.7
|
20.2
|
1.0
|
|
Magnesium binding site 4 out
of 6 in 3fvb
Go back to
Magnesium Binding Sites List in 3fvb
Magnesium binding site 4 out
of 6 in the Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis
 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 Ferritin (Bacterioferritin) From Brucella Melitensis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg163
b:34.3
occ:1.00
|
O
|
B:HOH196
|
1.9
|
30.9
|
1.0
|
O
|
A:HOH194
|
2.0
|
37.8
|
1.0
|
O
|
B:HOH191
|
2.1
|
33.7
|
1.0
|
O
|
A:HOH195
|
2.1
|
38.2
|
1.0
|
O
|
B:HOH193
|
2.1
|
36.5
|
1.0
|
O
|
A:HOH192
|
2.2
|
33.1
|
1.0
|
OD2
|
B:ASP60
|
4.1
|
28.7
|
1.0
|
O
|
B:HOH240
|
4.2
|
32.1
|
1.0
|
OD1
|
B:ASP60
|
4.2
|
27.0
|
1.0
|
OD1
|
A:ASN33
|
4.2
|
31.0
|
1.0
|
O
|
A:HOH244
|
4.4
|
45.9
|
1.0
|
NH1
|
A:ARG30
|
4.4
|
29.4
|
1.0
|
CG
|
B:ASP60
|
4.6
|
24.0
|
1.0
|
O
|
A:HOH356
|
4.7
|
45.3
|
1.0
|
|
Magnesium binding site 5 out
of 6 in 3fvb
Go back to
Magnesium Binding Sites List in 3fvb
Magnesium binding site 5 out
of 6 in the Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis
 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 Ferritin (Bacterioferritin) From Brucella Melitensis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg164
b:37.9
occ:1.00
|
O
|
B:HOH220
|
2.1
|
30.2
|
1.0
|
OD1
|
B:ASP34
|
2.1
|
22.9
|
1.0
|
O
|
A:HOH221
|
2.1
|
25.0
|
1.0
|
O
|
B:HOH222
|
2.2
|
33.0
|
1.0
|
O
|
B:HOH304
|
2.2
|
43.4
|
1.0
|
O
|
B:HOH223
|
2.9
|
28.4
|
1.0
|
CG
|
B:ASP34
|
3.1
|
24.4
|
1.0
|
OD2
|
B:ASP34
|
3.5
|
28.6
|
1.0
|
O
|
B:ASP34
|
4.1
|
20.7
|
1.0
|
CB
|
B:ASP34
|
4.5
|
21.7
|
1.0
|
O
|
A:HOH358
|
4.6
|
39.6
|
1.0
|
O
|
A:ILE63
|
4.7
|
21.1
|
1.0
|
C
|
B:ASP34
|
4.8
|
21.0
|
1.0
|
CA
|
B:ASP34
|
5.0
|
20.7
|
1.0
|
|
Magnesium binding site 6 out
of 6 in 3fvb
Go back to
Magnesium Binding Sites List in 3fvb
Magnesium binding site 6 out
of 6 in the Crystal Structure of Ferritin (Bacterioferritin) From Brucella Melitensis
 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 Ferritin (Bacterioferritin) From Brucella Melitensis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg165
b:61.2
occ:1.00
|
O
|
B:HOH375
|
2.1
|
51.5
|
1.0
|
O
|
A:HOH376
|
2.2
|
47.6
|
1.0
|
O
|
A:HOH377
|
2.3
|
47.8
|
1.0
|
O
|
B:HOH374
|
2.4
|
40.4
|
1.0
|
O
|
B:HOH216
|
2.6
|
43.9
|
1.0
|
OE2
|
B:GLU66
|
3.9
|
37.8
|
1.0
|
OG
|
B:SER0
|
4.2
|
43.1
|
1.0
|
OE1
|
B:GLU66
|
4.3
|
33.2
|
1.0
|
O
|
A:HOH247
|
4.3
|
47.4
|
1.0
|
CD
|
B:GLU66
|
4.5
|
33.6
|
1.0
|
CB
|
B:SER0
|
4.7
|
43.3
|
1.0
|
CA
|
B:SER0
|
4.9
|
43.3
|
1.0
|
|
Reference:
Seattle Structural Genomics Center For Infectious Disease(Ssgcid),
Seattle Structural Genomics Center For Infectious Disease (Ssgcid).
N/A N/A.
Page generated: Wed Aug 14 13:55:51 2024
|