Chlorine in PDB 2zy4: Dodecameric L-Aspartate Beta-Decarboxylase
Enzymatic activity of Dodecameric L-Aspartate Beta-Decarboxylase
All present enzymatic activity of Dodecameric L-Aspartate Beta-Decarboxylase:
4.1.1.12;
Protein crystallography data
The structure of Dodecameric L-Aspartate Beta-Decarboxylase, PDB code: 2zy4
was solved by
H.-J.Chen,
T.-P.Ko,
C.-Y.Lee,
N.-C.Wang,
A.H.-J.Wang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
30.00 /
2.00
|
Space group
|
C 2 2 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
149.953,
217.149,
207.154,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
15.7 /
20.5
|
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Dodecameric L-Aspartate Beta-Decarboxylase
(pdb code 2zy4). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the
Dodecameric L-Aspartate Beta-Decarboxylase, PDB code: 2zy4:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
Chlorine binding site 1 out
of 6 in 2zy4
Go back to
Chlorine Binding Sites List in 2zy4
Chlorine binding site 1 out
of 6 in the Dodecameric L-Aspartate Beta-Decarboxylase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Dodecameric L-Aspartate Beta-Decarboxylase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl4001
b:18.1
occ:1.00
|
N
|
A:GLY99
|
3.2
|
20.0
|
1.0
|
NE
|
A:ARG53
|
3.3
|
12.1
|
1.0
|
NH1
|
A:ARG49
|
3.4
|
17.8
|
1.0
|
N
|
A:GLU98
|
3.8
|
21.4
|
1.0
|
CG
|
A:ARG53
|
3.9
|
12.9
|
1.0
|
CA
|
A:GLY99
|
3.9
|
17.9
|
1.0
|
CD
|
A:ARG49
|
3.9
|
13.2
|
1.0
|
CB
|
A:ARG49
|
3.9
|
12.2
|
1.0
|
NH2
|
A:ARG53
|
3.9
|
10.7
|
1.0
|
CB
|
A:GLN97
|
4.0
|
21.3
|
1.0
|
O
|
A:HOH593
|
4.0
|
43.1
|
1.0
|
O
|
A:HOH599
|
4.1
|
44.9
|
1.0
|
CZ
|
A:ARG53
|
4.1
|
12.6
|
1.0
|
C
|
A:GLN97
|
4.1
|
19.9
|
1.0
|
CG
|
A:ARG49
|
4.2
|
13.4
|
1.0
|
CD
|
A:ARG53
|
4.2
|
13.0
|
1.0
|
C
|
A:GLU98
|
4.2
|
21.0
|
1.0
|
CA
|
A:GLN97
|
4.3
|
20.4
|
1.0
|
CA
|
A:GLU98
|
4.3
|
23.1
|
1.0
|
CZ
|
A:ARG49
|
4.3
|
15.5
|
1.0
|
CB
|
A:GLU98
|
4.5
|
25.4
|
1.0
|
NE
|
A:ARG49
|
4.5
|
16.0
|
1.0
|
O
|
A:HOH594
|
4.6
|
31.3
|
1.0
|
CD2
|
B:LEU56
|
4.7
|
14.8
|
1.0
|
O
|
A:ARG49
|
4.7
|
11.0
|
1.0
|
O
|
A:GLN97
|
4.8
|
22.1
|
1.0
|
N
|
A:VAL100
|
4.8
|
17.2
|
1.0
|
C
|
A:GLY99
|
4.9
|
16.7
|
1.0
|
CG
|
A:GLN97
|
4.9
|
19.4
|
1.0
|
CA
|
A:ARG49
|
4.9
|
12.7
|
1.0
|
C
|
A:ARG49
|
5.0
|
12.2
|
1.0
|
|
Chlorine binding site 2 out
of 6 in 2zy4
Go back to
Chlorine Binding Sites List in 2zy4
Chlorine binding site 2 out
of 6 in the Dodecameric L-Aspartate Beta-Decarboxylase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Dodecameric L-Aspartate Beta-Decarboxylase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl4002
b:20.9
occ:1.00
|
N
|
B:GLY99
|
3.2
|
22.3
|
1.0
|
NE
|
B:ARG53
|
3.2
|
13.1
|
1.0
|
NH1
|
B:ARG49
|
3.5
|
18.2
|
1.0
|
O
|
B:HOH792
|
3.6
|
49.6
|
1.0
|
O
|
B:HOH794
|
3.7
|
40.9
|
1.0
|
N
|
B:GLU98
|
3.7
|
22.0
|
1.0
|
CG
|
B:ARG53
|
3.8
|
11.7
|
1.0
|
NH2
|
B:ARG53
|
3.8
|
12.0
|
1.0
|
CD
|
B:ARG49
|
3.9
|
15.1
|
1.0
|
CA
|
B:GLY99
|
3.9
|
21.1
|
1.0
|
CB
|
B:GLN97
|
3.9
|
21.4
|
1.0
|
CB
|
B:ARG49
|
4.0
|
12.0
|
1.0
|
CZ
|
B:ARG53
|
4.0
|
14.7
|
1.0
|
C
|
B:GLN97
|
4.1
|
21.9
|
1.0
|
CD
|
B:ARG53
|
4.1
|
13.2
|
1.0
|
C
|
B:GLU98
|
4.2
|
23.5
|
1.0
|
CG
|
B:ARG49
|
4.2
|
12.5
|
1.0
|
CA
|
B:GLN97
|
4.2
|
22.7
|
1.0
|
CA
|
B:GLU98
|
4.3
|
24.7
|
1.0
|
CB
|
B:GLU98
|
4.3
|
26.2
|
1.0
|
CZ
|
B:ARG49
|
4.5
|
19.1
|
1.0
|
CD2
|
A:LEU56
|
4.5
|
14.4
|
1.0
|
NE
|
B:ARG49
|
4.6
|
16.3
|
1.0
|
O
|
B:ARG49
|
4.7
|
12.1
|
1.0
|
O
|
B:GLN97
|
4.8
|
21.5
|
1.0
|
CG
|
B:GLN97
|
4.8
|
22.3
|
1.0
|
N
|
B:VAL100
|
4.8
|
19.4
|
1.0
|
CA
|
B:ARG49
|
4.9
|
12.1
|
1.0
|
C
|
B:GLY99
|
4.9
|
20.5
|
1.0
|
C
|
B:ARG49
|
5.0
|
10.8
|
1.0
|
|
Chlorine binding site 3 out
of 6 in 2zy4
Go back to
Chlorine Binding Sites List in 2zy4
Chlorine binding site 3 out
of 6 in the Dodecameric L-Aspartate Beta-Decarboxylase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Dodecameric L-Aspartate Beta-Decarboxylase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cl4003
b:19.0
occ:1.00
|
N
|
C:GLY99
|
3.2
|
16.3
|
1.0
|
NE
|
C:ARG53
|
3.3
|
10.3
|
1.0
|
NH1
|
C:ARG49
|
3.4
|
18.0
|
1.0
|
O
|
C:HOH2271
|
3.4
|
41.6
|
1.0
|
CA
|
C:GLY99
|
3.8
|
16.0
|
1.0
|
CG
|
C:ARG53
|
3.8
|
10.3
|
1.0
|
CD
|
C:ARG49
|
3.8
|
14.7
|
1.0
|
CB
|
C:ARG49
|
3.9
|
9.7
|
1.0
|
O
|
C:HOH853
|
3.9
|
53.6
|
1.0
|
N
|
C:GLU98
|
3.9
|
21.1
|
1.0
|
CB
|
C:GLN97
|
3.9
|
23.8
|
1.0
|
NH2
|
C:ARG53
|
3.9
|
14.4
|
1.0
|
CZ
|
C:ARG53
|
4.1
|
13.7
|
1.0
|
C
|
C:GLN97
|
4.1
|
21.6
|
1.0
|
CG
|
C:ARG49
|
4.1
|
10.6
|
1.0
|
CD
|
C:ARG53
|
4.1
|
11.5
|
1.0
|
C
|
C:GLU98
|
4.3
|
18.8
|
1.0
|
CA
|
C:GLN97
|
4.3
|
22.9
|
1.0
|
CZ
|
C:ARG49
|
4.3
|
20.2
|
1.0
|
CA
|
C:GLU98
|
4.4
|
20.9
|
1.0
|
NE
|
C:ARG49
|
4.5
|
17.2
|
1.0
|
CD2
|
D:LEU56
|
4.5
|
11.3
|
1.0
|
CB
|
C:GLU98
|
4.6
|
22.1
|
1.0
|
O
|
C:HOH839
|
4.6
|
54.5
|
1.0
|
O
|
C:HOH855
|
4.7
|
34.6
|
1.0
|
O
|
C:GLN97
|
4.7
|
20.6
|
1.0
|
O
|
C:ARG49
|
4.7
|
10.2
|
1.0
|
N
|
C:VAL100
|
4.8
|
15.9
|
1.0
|
C
|
C:GLY99
|
4.8
|
16.5
|
1.0
|
CA
|
C:ARG49
|
4.9
|
10.7
|
1.0
|
CG
|
C:GLN97
|
4.9
|
21.3
|
1.0
|
C
|
C:ARG49
|
5.0
|
11.4
|
1.0
|
|
Chlorine binding site 4 out
of 6 in 2zy4
Go back to
Chlorine Binding Sites List in 2zy4
Chlorine binding site 4 out
of 6 in the Dodecameric L-Aspartate Beta-Decarboxylase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Dodecameric L-Aspartate Beta-Decarboxylase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cl4004
b:21.9
occ:1.00
|
N
|
D:GLY99
|
3.1
|
25.4
|
1.0
|
NE
|
D:ARG53
|
3.2
|
16.4
|
1.0
|
NH1
|
D:ARG49
|
3.4
|
23.7
|
1.0
|
CG
|
D:ARG53
|
3.7
|
13.1
|
1.0
|
CA
|
D:GLY99
|
3.8
|
24.0
|
1.0
|
N
|
D:GLU98
|
3.8
|
22.9
|
1.0
|
O
|
D:HOH886
|
3.8
|
44.9
|
1.0
|
CB
|
D:ARG49
|
3.8
|
12.2
|
1.0
|
CD
|
D:ARG49
|
3.8
|
20.4
|
1.0
|
NH2
|
D:ARG53
|
3.9
|
15.9
|
1.0
|
CB
|
D:GLN97
|
3.9
|
21.8
|
1.0
|
CZ
|
D:ARG53
|
4.0
|
15.2
|
1.0
|
CD
|
D:ARG53
|
4.0
|
12.9
|
1.0
|
C
|
D:GLN97
|
4.0
|
21.7
|
1.0
|
CG
|
D:ARG49
|
4.1
|
14.1
|
1.0
|
C
|
D:GLU98
|
4.2
|
24.9
|
1.0
|
CA
|
D:GLN97
|
4.3
|
21.3
|
1.0
|
CA
|
D:GLU98
|
4.3
|
24.8
|
1.0
|
CZ
|
D:ARG49
|
4.4
|
23.5
|
1.0
|
CB
|
D:GLU98
|
4.5
|
26.2
|
1.0
|
O
|
D:HOH884
|
4.5
|
48.1
|
1.0
|
CD2
|
C:LEU56
|
4.5
|
14.3
|
1.0
|
NE
|
D:ARG49
|
4.5
|
20.3
|
1.0
|
O
|
D:ARG49
|
4.6
|
13.1
|
1.0
|
N
|
D:VAL100
|
4.7
|
24.3
|
1.0
|
O
|
D:GLN97
|
4.7
|
22.7
|
1.0
|
C
|
D:GLY99
|
4.8
|
24.9
|
1.0
|
CA
|
D:ARG49
|
4.8
|
11.7
|
1.0
|
C
|
D:ARG49
|
4.9
|
12.4
|
1.0
|
CG
|
D:GLN97
|
4.9
|
19.7
|
1.0
|
|
Chlorine binding site 5 out
of 6 in 2zy4
Go back to
Chlorine Binding Sites List in 2zy4
Chlorine binding site 5 out
of 6 in the Dodecameric L-Aspartate Beta-Decarboxylase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Dodecameric L-Aspartate Beta-Decarboxylase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cl4005
b:20.8
occ:1.00
|
N
|
E:GLY99
|
3.2
|
19.6
|
1.0
|
NE
|
E:ARG53
|
3.2
|
14.0
|
1.0
|
NH1
|
E:ARG49
|
3.3
|
18.7
|
1.0
|
O
|
E:HOH552
|
3.6
|
36.8
|
1.0
|
CG
|
E:ARG53
|
3.8
|
12.3
|
1.0
|
N
|
E:GLU98
|
3.8
|
21.0
|
1.0
|
O
|
E:HOH553
|
3.8
|
43.4
|
1.0
|
CD
|
E:ARG49
|
3.8
|
17.9
|
1.0
|
CA
|
E:GLY99
|
3.9
|
19.2
|
1.0
|
CB
|
E:ARG49
|
3.9
|
13.1
|
1.0
|
NH2
|
E:ARG53
|
3.9
|
13.3
|
1.0
|
CB
|
E:GLN97
|
4.0
|
20.2
|
1.0
|
CZ
|
E:ARG53
|
4.1
|
15.7
|
1.0
|
C
|
E:GLN97
|
4.1
|
19.8
|
1.0
|
CD
|
E:ARG53
|
4.1
|
11.7
|
1.0
|
CG
|
E:ARG49
|
4.2
|
13.1
|
1.0
|
C
|
E:GLU98
|
4.2
|
20.7
|
1.0
|
CZ
|
E:ARG49
|
4.3
|
22.6
|
1.0
|
CA
|
E:GLN97
|
4.3
|
21.5
|
1.0
|
CA
|
E:GLU98
|
4.4
|
20.7
|
1.0
|
CB
|
E:GLU98
|
4.4
|
23.8
|
1.0
|
NE
|
E:ARG49
|
4.5
|
17.8
|
1.0
|
O
|
E:HOH1986
|
4.7
|
43.8
|
1.0
|
O
|
E:ARG49
|
4.7
|
10.8
|
1.0
|
O
|
E:GLN97
|
4.8
|
19.1
|
1.0
|
N
|
E:VAL100
|
4.8
|
17.1
|
1.0
|
CA
|
E:ARG49
|
4.9
|
12.3
|
1.0
|
C
|
E:GLY99
|
4.9
|
18.4
|
1.0
|
C
|
E:ARG49
|
4.9
|
11.8
|
1.0
|
CG
|
E:GLN97
|
5.0
|
20.4
|
1.0
|
|
Chlorine binding site 6 out
of 6 in 2zy4
Go back to
Chlorine Binding Sites List in 2zy4
Chlorine binding site 6 out
of 6 in the Dodecameric L-Aspartate Beta-Decarboxylase
Mono view
Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Dodecameric L-Aspartate Beta-Decarboxylase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Cl4006
b:24.3
occ:1.00
|
N
|
F:GLY99
|
3.2
|
23.6
|
1.0
|
NE
|
F:ARG53
|
3.3
|
12.8
|
1.0
|
NH1
|
F:ARG49
|
3.4
|
22.7
|
1.0
|
O
|
F:HOH2893
|
3.5
|
52.0
|
1.0
|
O
|
F:HOH551
|
3.5
|
45.3
|
1.0
|
CD
|
F:ARG49
|
3.7
|
16.7
|
1.0
|
N
|
F:GLU98
|
3.8
|
23.9
|
1.0
|
CG
|
F:ARG53
|
3.8
|
12.9
|
1.0
|
CA
|
F:GLY99
|
3.9
|
23.3
|
1.0
|
CB
|
F:ARG49
|
3.9
|
11.6
|
1.0
|
CB
|
F:GLN97
|
4.0
|
20.4
|
1.0
|
CG
|
F:ARG49
|
4.0
|
13.8
|
1.0
|
NH2
|
F:ARG53
|
4.0
|
12.1
|
1.0
|
C
|
F:GLN97
|
4.1
|
20.8
|
1.0
|
CZ
|
F:ARG53
|
4.1
|
13.5
|
1.0
|
CD
|
F:ARG53
|
4.2
|
13.4
|
1.0
|
C
|
F:GLU98
|
4.2
|
24.4
|
1.0
|
CA
|
F:GLN97
|
4.3
|
21.5
|
1.0
|
CA
|
F:GLU98
|
4.3
|
26.0
|
1.0
|
CZ
|
F:ARG49
|
4.4
|
23.1
|
1.0
|
CB
|
F:GLU98
|
4.5
|
29.0
|
1.0
|
NE
|
F:ARG49
|
4.5
|
17.8
|
1.0
|
O
|
F:GLN97
|
4.7
|
22.1
|
1.0
|
O
|
F:ARG49
|
4.8
|
9.8
|
1.0
|
N
|
F:VAL100
|
4.8
|
21.8
|
1.0
|
CA
|
F:ARG49
|
4.9
|
10.7
|
1.0
|
C
|
F:GLY99
|
4.9
|
23.0
|
1.0
|
CG
|
F:GLN97
|
4.9
|
21.2
|
1.0
|
C
|
F:ARG49
|
5.0
|
9.6
|
1.0
|
|
Reference:
H.-J.Chen,
T.-P.Ko,
C.-Y.Lee,
N.-C.Wang,
A.H.-J.Wang.
Structure, Assembly, and Mechanism of A Plp-Dependent Dodecameric L-Aspartate Beta-Decarboxylase Structure V. 17 517 2009.
ISSN: ISSN 0969-2126
PubMed: 19368885
DOI: 10.1016/J.STR.2009.02.013
Page generated: Sat Jul 20 15:38:27 2024
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