Magnesium in PDB 2zgz: Parm with Gmppnp
Protein crystallography data
The structure of Parm with Gmppnp, PDB code: 2zgz
was solved by
D.Popp,
A.Narita,
T.Oda,
T.Fujisawa,
H.Matsuo,
Y.Nitanai,
M.Iwasa,
K.Maeda,
H.Onishi,
Y.Maeda,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
45.41 /
2.25
|
Space group
|
P 41
|
Cell size a, b, c (Å), α, β, γ (°)
|
64.214,
64.214,
200.913,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
20.4 /
24.6
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Parm with Gmppnp
(pdb code 2zgz). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the
Parm with Gmppnp, PDB code: 2zgz:
Jump to Magnesium binding site number:
1;
2;
3;
4;
Magnesium binding site 1 out
of 4 in 2zgz
Go back to
Magnesium Binding Sites List in 2zgz
Magnesium binding site 1 out
of 4 in the Parm with Gmppnp
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Parm with Gmppnp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg321
b:44.6
occ:1.00
|
O1B
|
A:GNP323
|
2.3
|
40.8
|
1.0
|
O
|
A:HOH325
|
2.3
|
29.6
|
1.0
|
O
|
A:HOH326
|
2.4
|
35.4
|
1.0
|
O
|
A:HOH324
|
2.4
|
34.9
|
1.0
|
O
|
A:HOH327
|
2.4
|
30.1
|
1.0
|
O3G
|
A:GNP323
|
2.5
|
41.7
|
1.0
|
PB
|
A:GNP323
|
3.5
|
40.8
|
1.0
|
PG
|
A:GNP323
|
3.6
|
44.3
|
1.0
|
N3B
|
A:GNP323
|
3.8
|
43.1
|
1.0
|
OE2
|
A:GLU148
|
3.9
|
42.1
|
1.0
|
O
|
A:HOH329
|
4.1
|
25.2
|
1.0
|
O
|
A:HOH331
|
4.1
|
29.5
|
1.0
|
O2A
|
A:GNP323
|
4.2
|
36.2
|
1.0
|
O2G
|
A:GNP323
|
4.2
|
39.5
|
1.0
|
OD2
|
A:ASP170
|
4.2
|
41.9
|
1.0
|
OD2
|
A:ASP6
|
4.3
|
40.5
|
1.0
|
OD1
|
A:ASP6
|
4.3
|
43.6
|
1.0
|
NZ
|
A:LYS13
|
4.4
|
36.2
|
1.0
|
O3A
|
A:GNP323
|
4.4
|
35.6
|
1.0
|
O2B
|
A:GNP323
|
4.5
|
42.5
|
1.0
|
CD
|
A:GLU148
|
4.5
|
34.9
|
1.0
|
OE1
|
A:GLU148
|
4.6
|
40.8
|
1.0
|
PA
|
A:GNP323
|
4.6
|
37.5
|
1.0
|
OD1
|
A:ASP170
|
4.6
|
46.8
|
1.0
|
CG
|
A:ASP6
|
4.7
|
38.6
|
1.0
|
CA
|
A:GLY8
|
4.7
|
38.7
|
1.0
|
O1G
|
A:GNP323
|
4.8
|
48.0
|
1.0
|
O1A
|
A:GNP323
|
4.8
|
33.7
|
1.0
|
CA
|
A:GLY172
|
4.9
|
37.8
|
1.0
|
CG
|
A:ASP170
|
4.9
|
45.1
|
1.0
|
|
Magnesium binding site 2 out
of 4 in 2zgz
Go back to
Magnesium Binding Sites List in 2zgz
Magnesium binding site 2 out
of 4 in the Parm with Gmppnp
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Parm with Gmppnp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg322
b:43.4
occ:1.00
|
O
|
A:THR101
|
2.4
|
35.3
|
1.0
|
OD1
|
A:ASP7
|
2.4
|
37.7
|
1.0
|
O
|
A:HOH328
|
2.5
|
59.7
|
1.0
|
OE1
|
A:GLN73
|
2.5
|
38.8
|
1.0
|
O
|
A:ASP7
|
2.8
|
38.2
|
1.0
|
OG1
|
A:THR101
|
2.8
|
41.3
|
1.0
|
CG
|
A:ASP7
|
2.9
|
36.9
|
1.0
|
OD2
|
A:ASP7
|
3.2
|
40.1
|
1.0
|
C
|
A:THR101
|
3.2
|
37.8
|
1.0
|
CD
|
A:GLN73
|
3.2
|
41.6
|
1.0
|
NE2
|
A:GLN73
|
3.3
|
34.8
|
1.0
|
C
|
A:ASP7
|
3.6
|
31.8
|
1.0
|
NZ
|
A:LYS122
|
3.8
|
36.2
|
1.0
|
CA
|
A:THR101
|
3.8
|
36.7
|
1.0
|
CB
|
A:THR101
|
3.9
|
36.5
|
1.0
|
N
|
A:THR101
|
3.9
|
35.0
|
1.0
|
CB
|
A:ASP7
|
3.9
|
28.6
|
1.0
|
N
|
A:ASP7
|
4.0
|
34.2
|
1.0
|
CA
|
A:ASP7
|
4.0
|
28.1
|
1.0
|
CE
|
A:LYS122
|
4.1
|
21.6
|
1.0
|
N
|
A:LEU102
|
4.2
|
36.6
|
1.0
|
CA
|
A:LEU102
|
4.5
|
30.7
|
1.0
|
CG
|
A:GLN73
|
4.6
|
34.0
|
1.0
|
N
|
A:GLY8
|
4.7
|
36.5
|
1.0
|
OE2
|
A:GLU148
|
4.8
|
42.1
|
1.0
|
CD
|
A:PRO103
|
4.9
|
30.5
|
1.0
|
|
Magnesium binding site 3 out
of 4 in 2zgz
Go back to
Magnesium Binding Sites List in 2zgz
Magnesium binding site 3 out
of 4 in the Parm with Gmppnp
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Parm with Gmppnp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg321
b:45.8
occ:1.00
|
O1B
|
B:GNP323
|
2.3
|
41.0
|
1.0
|
O
|
B:HOH325
|
2.3
|
37.1
|
1.0
|
O
|
B:HOH326
|
2.3
|
36.2
|
1.0
|
O
|
B:HOH324
|
2.3
|
33.3
|
1.0
|
O
|
B:HOH327
|
2.4
|
29.2
|
1.0
|
O3G
|
B:GNP323
|
2.5
|
37.6
|
1.0
|
PB
|
B:GNP323
|
3.5
|
39.0
|
1.0
|
PG
|
B:GNP323
|
3.6
|
43.7
|
1.0
|
N3B
|
B:GNP323
|
3.8
|
40.4
|
1.0
|
OE2
|
B:GLU148
|
3.9
|
48.4
|
1.0
|
O
|
B:HOH331
|
4.1
|
27.8
|
1.0
|
O
|
B:HOH330
|
4.1
|
27.4
|
1.0
|
O2G
|
B:GNP323
|
4.1
|
37.0
|
1.0
|
O2A
|
B:GNP323
|
4.2
|
34.9
|
1.0
|
OD2
|
B:ASP6
|
4.2
|
38.2
|
1.0
|
OD1
|
B:ASP6
|
4.2
|
39.6
|
1.0
|
OD2
|
B:ASP170
|
4.3
|
42.5
|
1.0
|
NZ
|
B:LYS13
|
4.3
|
32.6
|
1.0
|
O3A
|
B:GNP323
|
4.5
|
36.2
|
1.0
|
O2B
|
B:GNP323
|
4.5
|
38.4
|
1.0
|
CD
|
B:GLU148
|
4.5
|
40.4
|
1.0
|
OE1
|
B:GLU148
|
4.5
|
49.2
|
1.0
|
CA
|
B:GLY8
|
4.6
|
36.8
|
1.0
|
PA
|
B:GNP323
|
4.7
|
36.1
|
1.0
|
OD1
|
B:ASP170
|
4.7
|
41.6
|
1.0
|
CG
|
B:ASP6
|
4.7
|
41.8
|
1.0
|
O1G
|
B:GNP323
|
4.8
|
43.8
|
1.0
|
O1A
|
B:GNP323
|
4.8
|
30.8
|
1.0
|
O
|
B:HOH374
|
4.9
|
49.6
|
1.0
|
CG
|
B:ASP170
|
4.9
|
43.0
|
1.0
|
CA
|
B:GLY172
|
5.0
|
35.2
|
1.0
|
|
Magnesium binding site 4 out
of 4 in 2zgz
Go back to
Magnesium Binding Sites List in 2zgz
Magnesium binding site 4 out
of 4 in the Parm with Gmppnp
Mono view
Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Parm with Gmppnp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg322
b:45.1
occ:1.00
|
O
|
B:THR101
|
2.4
|
37.4
|
1.0
|
OD1
|
B:ASP7
|
2.4
|
33.6
|
1.0
|
O
|
B:HOH328
|
2.4
|
50.6
|
1.0
|
OE1
|
B:GLN73
|
2.5
|
34.8
|
1.0
|
OG1
|
B:THR101
|
2.8
|
38.2
|
1.0
|
O
|
B:ASP7
|
2.8
|
36.5
|
1.0
|
CG
|
B:ASP7
|
2.9
|
39.7
|
1.0
|
C
|
B:THR101
|
3.2
|
35.9
|
1.0
|
CD
|
B:GLN73
|
3.2
|
37.7
|
1.0
|
NE2
|
B:GLN73
|
3.2
|
35.5
|
1.0
|
OD2
|
B:ASP7
|
3.3
|
35.3
|
1.0
|
C
|
B:ASP7
|
3.6
|
33.0
|
1.0
|
NZ
|
B:LYS122
|
3.8
|
32.5
|
1.0
|
CA
|
B:THR101
|
3.8
|
35.7
|
1.0
|
CB
|
B:THR101
|
3.8
|
35.5
|
1.0
|
N
|
B:THR101
|
3.9
|
38.1
|
1.0
|
CB
|
B:ASP7
|
4.0
|
29.2
|
1.0
|
N
|
B:ASP7
|
4.0
|
32.7
|
1.0
|
CA
|
B:ASP7
|
4.1
|
30.2
|
1.0
|
N
|
B:LEU102
|
4.1
|
36.9
|
1.0
|
CE
|
B:LYS122
|
4.2
|
27.8
|
1.0
|
CA
|
B:LEU102
|
4.4
|
32.9
|
1.0
|
CG
|
B:GLN73
|
4.6
|
32.5
|
1.0
|
N
|
B:GLY8
|
4.7
|
36.5
|
1.0
|
OE2
|
B:GLU148
|
4.7
|
48.4
|
1.0
|
CD
|
B:PRO103
|
4.8
|
30.9
|
1.0
|
|
Reference:
D.Popp,
A.Narita,
T.Oda,
T.Fujisawa,
H.Matsuo,
Y.Nitanai,
M.Iwasa,
K.Maeda,
H.Onishi,
Y.Maeda.
Molecular Structure of the Parm Polymer and the Mechanism Leading to Its Nucleotide-Driven Dynamic Instability Embo J. V. 27 570 2008.
ISSN: ISSN 0261-4189
PubMed: 18188150
DOI: 10.1038/SJ.EMBOJ.7601978
Page generated: Wed Aug 14 07:51:54 2024
|