Potassium in PDB 6gg4: Crystal Structure of M2 Pyk in Complex with Phenyalanine.
Enzymatic activity of Crystal Structure of M2 Pyk in Complex with Phenyalanine.
All present enzymatic activity of Crystal Structure of M2 Pyk in Complex with Phenyalanine.:
2.7.1.40;
Protein crystallography data
The structure of Crystal Structure of M2 Pyk in Complex with Phenyalanine., PDB code: 6gg4
was solved by
I.W.Mcnae,
M.Yuan,
M.D.Walkinshaw,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
162.06 /
2.46
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
97.370,
70.340,
168.640,
90.00,
106.06,
90.00
|
R / Rfree (%)
|
19.7 /
22.5
|
Potassium Binding Sites:
The binding sites of Potassium atom in the Crystal Structure of M2 Pyk in Complex with Phenyalanine.
(pdb code 6gg4). This binding sites where shown within
5.0 Angstroms radius around Potassium atom.
In total 4 binding sites of Potassium where determined in the
Crystal Structure of M2 Pyk in Complex with Phenyalanine., PDB code: 6gg4:
Jump to Potassium binding site number:
1;
2;
3;
4;
Potassium binding site 1 out
of 4 in 6gg4
Go back to
Potassium Binding Sites List in 6gg4
Potassium binding site 1 out
of 4 in the Crystal Structure of M2 Pyk in Complex with Phenyalanine.
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 1 of Crystal Structure of M2 Pyk in Complex with Phenyalanine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:K605
b:57.5
occ:1.00
|
O
|
A:HOH708
|
2.7
|
42.8
|
1.0
|
O
|
A:THR114
|
2.7
|
50.9
|
1.0
|
OD1
|
A:ASN75
|
2.7
|
48.7
|
1.0
|
OG
|
A:SER77
|
2.8
|
51.3
|
1.0
|
O
|
A:HOH770
|
3.0
|
56.4
|
1.0
|
OD1
|
A:ASP113
|
3.1
|
59.4
|
1.0
|
C
|
A:THR114
|
3.7
|
50.0
|
1.0
|
OG
|
A:SER243
|
3.8
|
55.9
|
1.0
|
CG
|
A:ASN75
|
3.8
|
50.7
|
1.0
|
CG
|
A:ASP113
|
3.9
|
55.2
|
1.0
|
O
|
A:ASP113
|
4.0
|
51.0
|
1.0
|
CB
|
A:SER77
|
4.0
|
53.5
|
1.0
|
CA
|
A:LYS115
|
4.2
|
49.4
|
1.0
|
N
|
A:SER77
|
4.3
|
52.2
|
1.0
|
N
|
A:LYS115
|
4.3
|
49.6
|
1.0
|
OE2
|
A:GLU118
|
4.3
|
64.7
|
1.0
|
NH2
|
A:ARG73
|
4.3
|
51.2
|
1.0
|
C
|
A:ASP113
|
4.3
|
50.9
|
1.0
|
ND2
|
A:ASN75
|
4.4
|
49.2
|
1.0
|
O
|
A:LYS115
|
4.4
|
47.1
|
1.0
|
NZ
|
A:LYS270
|
4.5
|
57.8
|
1.0
|
CB
|
A:ASP113
|
4.5
|
52.6
|
1.0
|
OD2
|
A:ASP113
|
4.6
|
55.0
|
1.0
|
CA
|
A:SER77
|
4.6
|
53.9
|
1.0
|
C
|
A:LYS115
|
4.6
|
49.4
|
1.0
|
N
|
A:THR114
|
4.7
|
50.0
|
1.0
|
CA
|
A:THR114
|
4.8
|
50.2
|
1.0
|
N
|
A:PHE76
|
4.9
|
53.4
|
1.0
|
CB
|
A:SER243
|
4.9
|
56.3
|
1.0
|
CB
|
A:ASN75
|
5.0
|
50.9
|
1.0
|
|
Potassium binding site 2 out
of 4 in 6gg4
Go back to
Potassium Binding Sites List in 6gg4
Potassium binding site 2 out
of 4 in the Crystal Structure of M2 Pyk in Complex with Phenyalanine.
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 2 of Crystal Structure of M2 Pyk in Complex with Phenyalanine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:K605
b:61.5
occ:1.00
|
O
|
B:THR114
|
2.7
|
47.7
|
1.0
|
OD1
|
B:ASN75
|
2.8
|
51.5
|
1.0
|
O
|
B:HOH715
|
2.8
|
45.3
|
1.0
|
OG
|
B:SER77
|
2.9
|
55.0
|
1.0
|
OD1
|
B:ASP113
|
3.0
|
56.0
|
1.0
|
O
|
B:HOH707
|
3.6
|
56.0
|
1.0
|
C
|
B:THR114
|
3.7
|
48.8
|
1.0
|
OG
|
B:SER243
|
3.8
|
48.1
|
1.0
|
CG
|
B:ASN75
|
3.8
|
51.0
|
1.0
|
CG
|
B:ASP113
|
3.9
|
54.8
|
1.0
|
O
|
B:HOH703
|
3.9
|
58.9
|
1.0
|
O
|
B:ASP113
|
4.0
|
45.6
|
1.0
|
CB
|
B:SER77
|
4.0
|
55.0
|
1.0
|
CA
|
B:LYS115
|
4.1
|
50.0
|
1.0
|
N
|
B:LYS115
|
4.2
|
50.9
|
1.0
|
N
|
B:SER77
|
4.3
|
52.9
|
1.0
|
OE2
|
B:GLU118
|
4.3
|
68.6
|
1.0
|
C
|
B:ASP113
|
4.3
|
47.5
|
1.0
|
O
|
B:LYS115
|
4.4
|
52.0
|
1.0
|
ND2
|
B:ASN75
|
4.4
|
49.9
|
1.0
|
NH2
|
B:ARG73
|
4.4
|
48.6
|
1.0
|
NZ
|
B:LYS270
|
4.5
|
61.9
|
1.0
|
CB
|
B:ASP113
|
4.5
|
51.0
|
1.0
|
OD2
|
B:ASP113
|
4.6
|
56.5
|
1.0
|
N
|
B:THR114
|
4.6
|
47.2
|
1.0
|
C
|
B:LYS115
|
4.6
|
51.0
|
1.0
|
CA
|
B:SER77
|
4.6
|
54.0
|
1.0
|
O
|
B:HOH777
|
4.7
|
79.8
|
1.0
|
CA
|
B:THR114
|
4.8
|
48.1
|
1.0
|
N
|
B:PHE76
|
4.9
|
51.5
|
1.0
|
CB
|
B:SER243
|
4.9
|
48.8
|
1.0
|
|
Potassium binding site 3 out
of 4 in 6gg4
Go back to
Potassium Binding Sites List in 6gg4
Potassium binding site 3 out
of 4 in the Crystal Structure of M2 Pyk in Complex with Phenyalanine.
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 3 of Crystal Structure of M2 Pyk in Complex with Phenyalanine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:K603
b:90.7
occ:1.00
|
OG
|
C:SER77
|
2.9
|
66.9
|
1.0
|
O
|
C:THR114
|
3.0
|
59.7
|
1.0
|
OD1
|
C:ASN75
|
3.0
|
54.0
|
1.0
|
OD1
|
C:ASP113
|
3.2
|
62.1
|
1.0
|
OG
|
C:SER243
|
3.9
|
67.8
|
1.0
|
C
|
C:THR114
|
4.0
|
59.3
|
1.0
|
CG
|
C:ASN75
|
4.0
|
54.5
|
1.0
|
CG
|
C:ASP113
|
4.0
|
57.6
|
1.0
|
CB
|
C:SER77
|
4.2
|
65.1
|
1.0
|
NH2
|
C:ARG73
|
4.3
|
52.0
|
1.0
|
CA
|
C:LYS115
|
4.3
|
64.3
|
1.0
|
O
|
C:LYS115
|
4.3
|
62.0
|
1.0
|
NZ
|
C:LYS270
|
4.3
|
63.5
|
1.0
|
O
|
C:ASP113
|
4.4
|
53.4
|
1.0
|
ND2
|
C:ASN75
|
4.4
|
53.4
|
1.0
|
N
|
C:LYS115
|
4.5
|
61.8
|
1.0
|
N
|
C:SER77
|
4.6
|
60.6
|
1.0
|
OD2
|
C:ASP113
|
4.6
|
57.9
|
1.0
|
C
|
C:LYS115
|
4.7
|
65.4
|
1.0
|
C
|
C:ASP113
|
4.7
|
54.4
|
1.0
|
CB
|
C:ASP113
|
4.8
|
55.1
|
1.0
|
CA
|
C:SER77
|
4.9
|
62.7
|
1.0
|
CB
|
C:SER243
|
5.0
|
64.6
|
1.0
|
N
|
C:THR114
|
5.0
|
56.2
|
1.0
|
|
Potassium binding site 4 out
of 4 in 6gg4
Go back to
Potassium Binding Sites List in 6gg4
Potassium binding site 4 out
of 4 in the Crystal Structure of M2 Pyk in Complex with Phenyalanine.
Mono view
Stereo pair view
|
A full contact list of Potassium with other atoms in the K binding
site number 4 of Crystal Structure of M2 Pyk in Complex with Phenyalanine. within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:K603
b:81.9
occ:1.00
|
O
|
D:THR114
|
2.8
|
59.1
|
1.0
|
OD1
|
D:ASN75
|
2.9
|
56.2
|
1.0
|
OD1
|
D:ASP113
|
3.0
|
60.7
|
1.0
|
OG
|
D:SER77
|
3.0
|
67.1
|
1.0
|
OG
|
D:SER243
|
3.7
|
57.8
|
1.0
|
CG
|
D:ASP113
|
3.8
|
57.7
|
1.0
|
C
|
D:THR114
|
3.8
|
59.5
|
1.0
|
CG
|
D:ASN75
|
3.9
|
57.7
|
1.0
|
O
|
D:ASP113
|
4.1
|
56.6
|
1.0
|
CB
|
D:SER77
|
4.2
|
68.4
|
1.0
|
NH2
|
D:ARG73
|
4.2
|
57.4
|
1.0
|
NZ
|
D:LYS270
|
4.2
|
58.8
|
1.0
|
CA
|
D:LYS115
|
4.3
|
64.9
|
1.0
|
N
|
D:LYS115
|
4.4
|
63.4
|
1.0
|
C
|
D:ASP113
|
4.4
|
55.8
|
1.0
|
O
|
D:LYS115
|
4.4
|
60.8
|
1.0
|
ND2
|
D:ASN75
|
4.4
|
58.9
|
1.0
|
OD2
|
D:ASP113
|
4.5
|
55.9
|
1.0
|
N
|
D:SER77
|
4.5
|
66.0
|
1.0
|
CB
|
D:ASP113
|
4.5
|
55.5
|
1.0
|
N
|
D:THR114
|
4.7
|
56.7
|
1.0
|
C
|
D:LYS115
|
4.7
|
63.4
|
1.0
|
CB
|
D:SER243
|
4.9
|
55.7
|
1.0
|
CA
|
D:SER77
|
4.9
|
69.1
|
1.0
|
CA
|
D:THR114
|
4.9
|
57.4
|
1.0
|
|
Reference:
M.Yuan,
I.W.Mcnae,
Y.Chen,
E.A.Blackburn,
M.A.Wear,
P.A.M.Michels,
L.A.Fothergill-Gilmore,
T.Hupp,
M.D.Walkinshaw.
An Allostatic Mechanism For M2 Pyruvate Kinase As An Amino-Acid Sensor. Biochem. J. V. 475 1821 2018.
ISSN: ESSN 1470-8728
PubMed: 29748232
DOI: 10.1042/BCJ20180171
Page generated: Mon Aug 12 16:08:56 2024
|