Magnesium in PDB 1aqf: Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
Enzymatic activity of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
All present enzymatic activity of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate:
2.7.1.40;
Protein crystallography data
The structure of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate, PDB code: 1aqf
was solved by
T.M.Larsen,
M.M.Benning,
G.E.Wesenberg,
I.Rayment,
G.H.Reed,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
30.00 /
2.70
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
144.400,
112.600,
171.200,
90.00,
93.70,
90.00
|
R / Rfree (%)
|
n/a /
n/a
|
Other elements in 1aqf:
The structure of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate also contains other interesting chemical elements:
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
(pdb code 1aqf). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 8 binding sites of Magnesium where determined in the
Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate, PDB code: 1aqf:
Jump to Magnesium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
Magnesium binding site 1 out
of 8 in 1aqf
Go back to
Magnesium Binding Sites List in 1aqf
Magnesium binding site 1 out
of 8 in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 1 of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg534
b:19.4
occ:1.00
|
O1
|
A:PEQ532
|
2.0
|
62.7
|
1.0
|
O3P
|
A:PEQ532
|
2.0
|
76.7
|
1.0
|
OD2
|
A:ASP295
|
2.1
|
94.8
|
1.0
|
OE2
|
A:GLU271
|
2.1
|
16.9
|
1.0
|
O2
|
A:PEQ532
|
2.3
|
75.9
|
1.0
|
P
|
A:PEQ532
|
2.5
|
87.8
|
1.0
|
C1
|
A:PEQ532
|
2.7
|
16.0
|
1.0
|
C2
|
A:PEQ532
|
2.9
|
24.4
|
1.0
|
CG
|
A:ASP295
|
3.1
|
11.7
|
1.0
|
O2P
|
A:PEQ532
|
3.2
|
76.5
|
1.0
|
CD
|
A:GLU271
|
3.2
|
30.6
|
1.0
|
CB
|
A:ASP295
|
3.6
|
37.8
|
1.0
|
O2'
|
A:PEQ532
|
3.9
|
39.1
|
1.0
|
CG
|
A:GLU271
|
3.9
|
34.0
|
1.0
|
O1P
|
A:PEQ532
|
3.9
|
79.1
|
1.0
|
OE1
|
A:GLU271
|
4.2
|
30.1
|
1.0
|
OD1
|
A:ASP295
|
4.3
|
22.9
|
1.0
|
C3
|
A:PEQ532
|
4.3
|
33.3
|
1.0
|
CZ
|
A:PHE243
|
4.5
|
49.2
|
1.0
|
CE1
|
A:PHE243
|
4.6
|
11.6
|
1.0
|
N
|
A:ASP295
|
4.6
|
16.5
|
1.0
|
NZ
|
A:LYS269
|
4.7
|
3.1
|
1.0
|
CA
|
A:ASP295
|
4.7
|
10.2
|
1.0
|
|
Magnesium binding site 2 out
of 8 in 1aqf
Go back to
Magnesium Binding Sites List in 1aqf
Magnesium binding site 2 out
of 8 in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 2 of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg534
b:49.0
occ:1.00
|
OE1
|
B:GLU271
|
2.3
|
0.0
|
1.0
|
OD2
|
B:ASP295
|
2.3
|
61.3
|
1.0
|
CD
|
B:GLU271
|
3.1
|
25.9
|
1.0
|
OE2
|
B:GLU271
|
3.3
|
83.2
|
1.0
|
CG
|
B:ASP295
|
3.4
|
0.0
|
1.0
|
CB
|
B:ASP295
|
4.2
|
38.0
|
1.0
|
OD1
|
B:ASP295
|
4.3
|
66.7
|
1.0
|
O3P
|
B:PEQ532
|
4.4
|
77.5
|
0.5
|
CG
|
B:GLU271
|
4.5
|
10.3
|
1.0
|
OG
|
B:SER242
|
4.7
|
13.6
|
1.0
|
O2
|
B:PEQ532
|
4.8
|
34.9
|
0.5
|
CB
|
B:SER242
|
4.9
|
21.8
|
1.0
|
O
|
B:LYS114
|
5.0
|
30.4
|
1.0
|
|
Magnesium binding site 3 out
of 8 in 1aqf
Go back to
Magnesium Binding Sites List in 1aqf
Magnesium binding site 3 out
of 8 in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 3 of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg534
b:42.8
occ:1.00
|
OE1
|
C:GLU271
|
2.3
|
74.4
|
1.0
|
OD2
|
C:ASP295
|
2.4
|
70.0
|
1.0
|
O
|
C:HOH6071
|
2.9
|
53.6
|
1.0
|
CG
|
C:ASP295
|
3.3
|
38.9
|
1.0
|
CD
|
C:GLU271
|
3.4
|
30.1
|
1.0
|
OE2
|
C:GLU271
|
4.0
|
55.7
|
1.0
|
CB
|
C:ASP295
|
4.0
|
60.3
|
1.0
|
OD1
|
C:ASP295
|
4.2
|
99.1
|
1.0
|
CG
|
C:GLU271
|
4.7
|
8.8
|
1.0
|
O3P
|
C:PEQ532
|
4.7
|
74.5
|
0.5
|
O2P
|
C:PEQ532
|
4.9
|
57.3
|
0.5
|
|
Magnesium binding site 4 out
of 8 in 1aqf
Go back to
Magnesium Binding Sites List in 1aqf
Magnesium binding site 4 out
of 8 in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 4 of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg534
b:40.8
occ:1.00
|
OD2
|
D:ASP295
|
2.3
|
47.4
|
1.0
|
OE2
|
D:GLU271
|
2.3
|
56.0
|
1.0
|
CG
|
D:ASP295
|
3.1
|
0.0
|
1.0
|
CD
|
D:GLU271
|
3.2
|
23.3
|
1.0
|
OD1
|
D:ASP295
|
3.7
|
31.0
|
1.0
|
OE1
|
D:GLU271
|
3.9
|
46.5
|
1.0
|
CB
|
D:ASP295
|
4.1
|
17.9
|
1.0
|
CG
|
D:GLU271
|
4.3
|
1.0
|
1.0
|
O
|
D:HOH6034
|
4.8
|
32.2
|
1.0
|
CB
|
D:GLU271
|
4.8
|
30.0
|
1.0
|
O1
|
D:PEQ532
|
4.9
|
51.0
|
0.5
|
|
Magnesium binding site 5 out
of 8 in 1aqf
Go back to
Magnesium Binding Sites List in 1aqf
Magnesium binding site 5 out
of 8 in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 5 of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Mg534
b:82.0
occ:1.00
|
OE1
|
E:GLU271
|
2.9
|
52.2
|
1.0
|
O2P
|
E:PEQ532
|
3.1
|
0.0
|
0.5
|
OD2
|
E:ASP295
|
3.2
|
77.6
|
1.0
|
O
|
E:LYS114
|
3.5
|
72.7
|
1.0
|
OE2
|
E:GLU271
|
3.6
|
58.2
|
1.0
|
CD
|
E:GLU271
|
3.6
|
0.0
|
1.0
|
K
|
E:K533
|
4.1
|
81.8
|
1.0
|
CB
|
E:SER242
|
4.3
|
30.6
|
1.0
|
CG
|
E:ASP295
|
4.3
|
0.0
|
1.0
|
P
|
E:PEQ532
|
4.4
|
82.4
|
0.5
|
OG
|
E:SER242
|
4.5
|
0.0
|
1.0
|
C
|
E:LYS114
|
4.6
|
49.2
|
1.0
|
O2
|
E:PEQ532
|
4.6
|
86.3
|
0.5
|
O3P
|
E:PEQ532
|
4.8
|
58.8
|
0.5
|
|
Magnesium binding site 6 out
of 8 in 1aqf
Go back to
Magnesium Binding Sites List in 1aqf
Magnesium binding site 6 out
of 8 in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 6 of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Mg534
b:45.0
occ:1.00
|
OD2
|
F:ASP295
|
2.2
|
0.0
|
1.0
|
OE2
|
F:GLU271
|
2.3
|
38.4
|
1.0
|
CG
|
F:ASP295
|
3.3
|
49.3
|
1.0
|
CD
|
F:GLU271
|
3.5
|
25.1
|
1.0
|
OD1
|
F:ASP295
|
4.1
|
83.5
|
1.0
|
CB
|
F:ASP295
|
4.3
|
24.6
|
1.0
|
OE1
|
F:GLU271
|
4.4
|
63.1
|
1.0
|
CG
|
F:GLU271
|
4.5
|
32.4
|
1.0
|
CB
|
F:SER242
|
4.8
|
1.0
|
1.0
|
O1
|
F:PEQ532
|
4.9
|
55.4
|
0.5
|
O3P
|
F:PEQ532
|
4.9
|
74.2
|
0.5
|
O2P
|
F:PEQ532
|
4.9
|
30.0
|
0.5
|
|
Magnesium binding site 7 out
of 8 in 1aqf
Go back to
Magnesium Binding Sites List in 1aqf
Magnesium binding site 7 out
of 8 in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 7 of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Mg534
b:52.5
occ:1.00
|
OD2
|
G:ASP295
|
2.1
|
77.0
|
1.0
|
OE2
|
G:GLU271
|
2.9
|
43.0
|
1.0
|
CG
|
G:ASP295
|
3.2
|
0.0
|
1.0
|
OD1
|
G:ASP295
|
3.8
|
73.8
|
1.0
|
CD
|
G:GLU271
|
3.9
|
0.0
|
1.0
|
CB
|
G:ASP295
|
4.3
|
49.9
|
1.0
|
OE1
|
G:GLU271
|
4.4
|
17.5
|
1.0
|
O1
|
G:PEQ532
|
4.9
|
50.2
|
0.5
|
CD1
|
G:PHE243
|
4.9
|
88.6
|
1.0
|
ND2
|
G:ASN209
|
5.0
|
39.3
|
1.0
|
|
Magnesium binding site 8 out
of 8 in 1aqf
Go back to
Magnesium Binding Sites List in 1aqf
Magnesium binding site 8 out
of 8 in the Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate
 Mono view
 Stereo pair view
|
A full contact list of Magnesium with other atoms in the Mg binding
site number 8 of Pyruvate Kinase From Rabbit Muscle with Mg, K, and L- Phospholactate within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Mg534
b:64.3
occ:1.00
|
OE1
|
H:GLU271
|
2.3
|
35.4
|
1.0
|
OD2
|
H:ASP295
|
2.4
|
92.2
|
1.0
|
CD
|
H:GLU271
|
3.3
|
19.4
|
1.0
|
CG
|
H:ASP295
|
3.5
|
37.9
|
1.0
|
OE2
|
H:GLU271
|
3.8
|
55.3
|
1.0
|
CB
|
H:ASP295
|
4.3
|
46.4
|
1.0
|
O2P
|
H:PEQ532
|
4.4
|
90.0
|
0.5
|
OD1
|
H:ASP295
|
4.5
|
83.8
|
1.0
|
CG
|
H:GLU271
|
4.6
|
3.3
|
1.0
|
|
Reference:
T.M.Larsen,
M.M.Benning,
G.E.Wesenberg,
I.Rayment,
G.H.Reed.
Ligand-Induced Domain Movement in Pyruvate Kinase: Structure of the Enzyme From Rabbit Muscle with MG2+, K+, and L-Phospholactate at 2.7 A Resolution. Arch.Biochem.Biophys. V. 345 199 1997.
ISSN: ISSN 0003-9861
PubMed: 9308890
DOI: 10.1006/ABBI.1997.0257
Page generated: Tue Aug 13 02:07:24 2024
|