Magnesium in PDB 1ovm: Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae
Enzymatic activity of Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae
All present enzymatic activity of Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae:
4.1.1.74;
Protein crystallography data
The structure of Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae, PDB code: 1ovm
was solved by
A.Schutz,
T.Sandalova,
S.Ricagno,
G.Hubner,
S.Konig,
G.Schneider,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.56 /
2.65
|
Space group
|
P 21 21 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
132.200,
151.620,
107.550,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
20.5 /
23.6
|
Magnesium Binding Sites:
The binding sites of Magnesium atom in the Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae
(pdb code 1ovm). This binding sites where shown within
5.0 Angstroms radius around Magnesium atom.
In total 4 binding sites of Magnesium where determined in the
Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae, PDB code: 1ovm:
Jump to Magnesium binding site number:
1;
2;
3;
4;
Magnesium binding site 1 out
of 4 in 1ovm
Go back to
Magnesium Binding Sites List in 1ovm
Magnesium binding site 1 out
of 4 in the Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae
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 Indolepyruvate Decarboxylase From Enterobacter Cloacae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Mg601
b:23.6
occ:1.00
|
O
|
A:HOH647
|
2.2
|
22.7
|
1.0
|
OD1
|
A:ASN462
|
2.2
|
35.6
|
1.0
|
OD1
|
A:ASP435
|
2.3
|
25.8
|
1.0
|
O
|
A:GLY464
|
2.3
|
27.7
|
1.0
|
O2A
|
A:TPP600
|
2.4
|
21.6
|
1.0
|
O3B
|
A:TPP600
|
2.5
|
27.0
|
1.0
|
CG
|
A:ASN462
|
3.0
|
31.5
|
1.0
|
PB
|
A:TPP600
|
3.1
|
26.4
|
1.0
|
ND2
|
A:ASN462
|
3.2
|
30.5
|
1.0
|
O1B
|
A:TPP600
|
3.2
|
25.5
|
1.0
|
CG
|
A:ASP435
|
3.3
|
24.4
|
1.0
|
O3A
|
A:TPP600
|
3.3
|
25.6
|
1.0
|
PA
|
A:TPP600
|
3.5
|
23.5
|
1.0
|
C
|
A:GLY464
|
3.6
|
30.8
|
1.0
|
O
|
A:LEU460
|
3.7
|
28.7
|
1.0
|
N
|
A:ASP435
|
3.7
|
26.7
|
1.0
|
OD2
|
A:ASP435
|
3.8
|
23.8
|
1.0
|
N
|
A:GLY436
|
4.1
|
24.1
|
1.0
|
N
|
A:GLY464
|
4.3
|
33.0
|
1.0
|
N
|
A:ASN462
|
4.3
|
28.9
|
1.0
|
CA
|
A:GLY434
|
4.4
|
26.3
|
1.0
|
O1A
|
A:TPP600
|
4.4
|
26.4
|
1.0
|
CB
|
A:ASP435
|
4.4
|
24.7
|
1.0
|
CB
|
A:ASN462
|
4.4
|
30.4
|
1.0
|
O7
|
A:TPP600
|
4.4
|
24.5
|
1.0
|
CA
|
A:GLY464
|
4.5
|
30.8
|
1.0
|
C
|
A:GLY434
|
4.5
|
26.8
|
1.0
|
CG2
|
A:THR466
|
4.5
|
29.4
|
1.0
|
N
|
A:TYR465
|
4.5
|
30.4
|
1.0
|
CA
|
A:ASP435
|
4.5
|
24.5
|
1.0
|
N
|
A:THR466
|
4.5
|
30.1
|
1.0
|
O2B
|
A:TPP600
|
4.5
|
27.7
|
1.0
|
CA
|
A:TYR465
|
4.6
|
29.3
|
1.0
|
CA
|
A:ASN462
|
4.8
|
30.2
|
1.0
|
C
|
A:ASP435
|
4.8
|
24.8
|
1.0
|
C
|
A:LEU460
|
4.9
|
28.6
|
1.0
|
C
|
A:ASN462
|
4.9
|
31.1
|
1.0
|
|
Magnesium binding site 2 out
of 4 in 1ovm
Go back to
Magnesium Binding Sites List in 1ovm
Magnesium binding site 2 out
of 4 in the Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae
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 Indolepyruvate Decarboxylase From Enterobacter Cloacae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Mg601
b:19.9
occ:1.00
|
OD1
|
B:ASN462
|
2.2
|
32.0
|
1.0
|
OD1
|
B:ASP435
|
2.3
|
23.8
|
1.0
|
O
|
B:HOH660
|
2.3
|
18.9
|
1.0
|
O2A
|
B:TPP600
|
2.4
|
22.3
|
1.0
|
O
|
B:GLY464
|
2.4
|
29.0
|
1.0
|
O3B
|
B:TPP600
|
2.6
|
24.9
|
1.0
|
CG
|
B:ASN462
|
3.0
|
29.1
|
1.0
|
ND2
|
B:ASN462
|
3.1
|
27.3
|
1.0
|
PB
|
B:TPP600
|
3.2
|
26.1
|
1.0
|
O1B
|
B:TPP600
|
3.2
|
27.4
|
1.0
|
CG
|
B:ASP435
|
3.2
|
23.3
|
1.0
|
O3A
|
B:TPP600
|
3.4
|
25.0
|
1.0
|
PA
|
B:TPP600
|
3.5
|
22.9
|
1.0
|
C
|
B:GLY464
|
3.6
|
30.3
|
1.0
|
O
|
B:LEU460
|
3.6
|
29.4
|
1.0
|
N
|
B:ASP435
|
3.7
|
24.2
|
1.0
|
OD2
|
B:ASP435
|
3.7
|
20.5
|
1.0
|
N
|
B:GLY436
|
4.1
|
23.6
|
1.0
|
N
|
B:GLY464
|
4.3
|
30.8
|
1.0
|
N
|
B:ASN462
|
4.3
|
28.0
|
1.0
|
CB
|
B:ASP435
|
4.4
|
24.0
|
1.0
|
CA
|
B:GLY434
|
4.4
|
24.4
|
1.0
|
O1A
|
B:TPP600
|
4.4
|
23.2
|
1.0
|
CB
|
B:ASN462
|
4.4
|
28.2
|
1.0
|
O7
|
B:TPP600
|
4.4
|
25.3
|
1.0
|
C
|
B:GLY434
|
4.5
|
24.0
|
1.0
|
CA
|
B:ASP435
|
4.5
|
23.6
|
1.0
|
CA
|
B:GLY464
|
4.5
|
30.5
|
1.0
|
N
|
B:TYR465
|
4.5
|
29.0
|
1.0
|
N
|
B:THR466
|
4.5
|
30.3
|
1.0
|
CG2
|
B:THR466
|
4.6
|
27.0
|
1.0
|
O2B
|
B:TPP600
|
4.6
|
25.7
|
1.0
|
CA
|
B:TYR465
|
4.6
|
28.8
|
1.0
|
CA
|
B:ASN462
|
4.8
|
29.1
|
1.0
|
C
|
B:LEU460
|
4.8
|
28.4
|
1.0
|
C
|
B:ASP435
|
4.8
|
24.0
|
1.0
|
C
|
B:ASN462
|
4.9
|
30.0
|
1.0
|
O
|
B:HOH603
|
5.0
|
20.8
|
1.0
|
|
Magnesium binding site 3 out
of 4 in 1ovm
Go back to
Magnesium Binding Sites List in 1ovm
Magnesium binding site 3 out
of 4 in the Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae
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 Indolepyruvate Decarboxylase From Enterobacter Cloacae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Mg601
b:29.1
occ:1.00
|
OD1
|
C:ASP435
|
2.3
|
32.0
|
1.0
|
OD1
|
C:ASN462
|
2.3
|
36.4
|
1.0
|
O2A
|
C:TPP600
|
2.4
|
28.3
|
1.0
|
O
|
C:GLY464
|
2.6
|
28.6
|
1.0
|
O3B
|
C:TPP600
|
2.7
|
30.4
|
1.0
|
CG
|
C:ASN462
|
3.0
|
33.6
|
1.0
|
O1B
|
C:TPP600
|
3.0
|
31.0
|
1.0
|
CG
|
C:ASP435
|
3.1
|
30.6
|
1.0
|
PB
|
C:TPP600
|
3.2
|
32.7
|
1.0
|
ND2
|
C:ASN462
|
3.2
|
34.0
|
1.0
|
O
|
C:LEU460
|
3.3
|
29.9
|
1.0
|
O3A
|
C:TPP600
|
3.4
|
29.1
|
1.0
|
N
|
C:ASP435
|
3.4
|
26.9
|
1.0
|
PA
|
C:TPP600
|
3.5
|
27.1
|
1.0
|
OD2
|
C:ASP435
|
3.6
|
30.1
|
1.0
|
C
|
C:GLY464
|
3.9
|
32.1
|
1.0
|
N
|
C:GLY436
|
4.1
|
26.3
|
1.0
|
CA
|
C:GLY434
|
4.1
|
26.8
|
1.0
|
C
|
C:GLY434
|
4.2
|
25.8
|
1.0
|
CB
|
C:ASP435
|
4.2
|
28.8
|
1.0
|
O1A
|
C:TPP600
|
4.2
|
28.6
|
1.0
|
N
|
C:ASN462
|
4.3
|
31.2
|
1.0
|
CA
|
C:ASP435
|
4.3
|
27.8
|
1.0
|
CB
|
C:ASN462
|
4.4
|
31.8
|
1.0
|
C
|
C:LEU460
|
4.5
|
29.2
|
1.0
|
N
|
C:GLY464
|
4.5
|
34.9
|
1.0
|
O7
|
C:TPP600
|
4.5
|
29.7
|
1.0
|
O2B
|
C:TPP600
|
4.6
|
30.6
|
1.0
|
CG2
|
C:THR466
|
4.7
|
31.2
|
1.0
|
CA
|
C:GLY464
|
4.7
|
32.6
|
1.0
|
C
|
C:ASP435
|
4.7
|
27.2
|
1.0
|
CA
|
C:ASN462
|
4.8
|
32.1
|
1.0
|
N
|
C:THR466
|
4.8
|
32.4
|
1.0
|
N
|
C:TYR465
|
4.8
|
31.6
|
1.0
|
CA
|
C:TYR465
|
5.0
|
30.7
|
1.0
|
C
|
C:ASN462
|
5.0
|
32.6
|
1.0
|
|
Magnesium binding site 4 out
of 4 in 1ovm
Go back to
Magnesium Binding Sites List in 1ovm
Magnesium binding site 4 out
of 4 in the Crystal Structure of Indolepyruvate Decarboxylase From Enterobacter Cloacae
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 Indolepyruvate Decarboxylase From Enterobacter Cloacae within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Mg601
b:27.1
occ:1.00
|
OD1
|
D:ASP435
|
2.3
|
29.0
|
1.0
|
OD1
|
D:ASN462
|
2.3
|
36.4
|
1.0
|
O2A
|
D:TPP600
|
2.4
|
27.5
|
1.0
|
O
|
D:GLY464
|
2.5
|
30.6
|
1.0
|
O3B
|
D:TPP600
|
2.5
|
26.9
|
1.0
|
O1B
|
D:TPP600
|
3.0
|
29.9
|
1.0
|
PB
|
D:TPP600
|
3.1
|
31.2
|
1.0
|
CG
|
D:ASN462
|
3.1
|
32.8
|
1.0
|
ND2
|
D:ASN462
|
3.2
|
33.0
|
1.0
|
O3A
|
D:TPP600
|
3.3
|
29.1
|
1.0
|
CG
|
D:ASP435
|
3.3
|
28.6
|
1.0
|
PA
|
D:TPP600
|
3.5
|
31.7
|
1.0
|
O
|
D:LEU460
|
3.5
|
33.0
|
1.0
|
N
|
D:ASP435
|
3.6
|
27.8
|
1.0
|
C
|
D:GLY464
|
3.7
|
32.2
|
1.0
|
OD2
|
D:ASP435
|
4.0
|
28.9
|
1.0
|
N
|
D:GLY436
|
4.1
|
26.9
|
1.0
|
CA
|
D:GLY434
|
4.2
|
26.9
|
1.0
|
O1A
|
D:TPP600
|
4.3
|
31.6
|
1.0
|
C
|
D:GLY434
|
4.3
|
27.4
|
1.0
|
N
|
D:ASN462
|
4.3
|
31.1
|
1.0
|
CB
|
D:ASP435
|
4.4
|
28.2
|
1.0
|
CA
|
D:ASP435
|
4.4
|
27.1
|
1.0
|
CB
|
D:ASN462
|
4.5
|
30.5
|
1.0
|
N
|
D:GLY464
|
4.5
|
35.0
|
1.0
|
O7
|
D:TPP600
|
4.5
|
31.4
|
1.0
|
O2B
|
D:TPP600
|
4.5
|
28.9
|
1.0
|
CA
|
D:GLY464
|
4.7
|
32.6
|
1.0
|
N
|
D:THR466
|
4.7
|
32.8
|
1.0
|
CG2
|
D:THR466
|
4.7
|
30.1
|
1.0
|
N
|
D:TYR465
|
4.7
|
31.7
|
1.0
|
C
|
D:LEU460
|
4.7
|
31.4
|
1.0
|
CA
|
D:TYR465
|
4.8
|
31.2
|
1.0
|
C
|
D:ASP435
|
4.8
|
27.4
|
1.0
|
CA
|
D:ASN462
|
4.9
|
31.6
|
1.0
|
O
|
D:HOH602
|
4.9
|
18.9
|
1.0
|
|
Reference:
A.Schutz,
T.Sandalova,
S.Ricagno,
G.Hubner,
S.Konig,
G.Schneider.
Crystal Structure of Thiamindiphosphate-Dependent Indolepyruvate Decarboxylase From Enterobacter Cloacae, An Enzyme Involved in the Biosynthesis of the Plant Hormone Indole-3-Acetic Acid Eur.J.Biochem. V. 270 2312 2003.
ISSN: ISSN 0014-2956
PubMed: 12752451
DOI: 10.1046/J.1432-1033.2003.03601.X
Page generated: Tue Aug 13 10:43:38 2024
|