Copper in PDB 1ekj: The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum
Enzymatic activity of The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum
All present enzymatic activity of The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum:
4.2.1.1;
Protein crystallography data
The structure of The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum, PDB code: 1ekj
was solved by
M.S.Kimber,
E.F.Pai,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
40.00 /
1.93
|
Space group
|
C 2 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
136.909,
143.318,
202.135,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
22.9 /
25
|
Other elements in 1ekj:
The structure of The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum also contains other interesting chemical elements:
Copper Binding Sites:
The binding sites of Copper atom in the The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum
(pdb code 1ekj). This binding sites where shown within
5.0 Angstroms radius around Copper atom.
In total 4 binding sites of Copper where determined in the
The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum, PDB code: 1ekj:
Jump to Copper binding site number:
1;
2;
3;
4;
Copper binding site 1 out
of 4 in 1ekj
Go back to
Copper Binding Sites List in 1ekj
Copper binding site 1 out
of 4 in the The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 1 of The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cu4
b:73.5
occ:0.50
|
O
|
B:HOH1085
|
2.0
|
44.3
|
1.0
|
SG
|
A:CYS166
|
2.5
|
71.4
|
1.0
|
SG
|
B:CYS166
|
2.7
|
82.0
|
1.0
|
CD
|
B:PRO167
|
3.4
|
83.7
|
1.0
|
CG
|
B:PRO167
|
3.5
|
83.6
|
1.0
|
NH1
|
B:ARG182
|
3.6
|
58.7
|
1.0
|
OG
|
B:SER168
|
3.7
|
92.5
|
1.0
|
NH1
|
A:ARG182
|
3.8
|
46.8
|
1.0
|
N
|
B:SER168
|
4.0
|
88.1
|
1.0
|
CB
|
B:SER168
|
4.0
|
90.8
|
1.0
|
OG
|
A:SER168
|
4.1
|
75.0
|
1.0
|
CB
|
B:CYS166
|
4.1
|
80.5
|
1.0
|
N
|
B:PRO167
|
4.1
|
83.0
|
1.0
|
CB
|
A:CYS166
|
4.2
|
65.8
|
1.0
|
CD
|
A:PRO167
|
4.4
|
70.2
|
1.0
|
CA
|
B:CYS166
|
4.4
|
80.4
|
1.0
|
CB
|
A:SER168
|
4.4
|
74.0
|
1.0
|
CD
|
B:ARG182
|
4.5
|
58.5
|
1.0
|
C
|
B:CYS166
|
4.5
|
81.4
|
1.0
|
CG
|
A:PRO167
|
4.6
|
70.1
|
1.0
|
CZ
|
B:ARG182
|
4.6
|
58.8
|
1.0
|
CA
|
B:SER168
|
4.7
|
89.9
|
1.0
|
CD
|
A:ARG182
|
4.7
|
46.9
|
1.0
|
CA
|
A:CYS166
|
4.8
|
65.5
|
1.0
|
N
|
A:SER168
|
4.8
|
72.4
|
1.0
|
CB
|
B:PRO167
|
4.8
|
84.0
|
1.0
|
CA
|
B:PRO167
|
4.9
|
84.5
|
1.0
|
CZ
|
A:ARG182
|
5.0
|
45.3
|
1.0
|
C
|
B:PRO167
|
5.0
|
86.2
|
1.0
|
|
Copper binding site 2 out
of 4 in 1ekj
Go back to
Copper Binding Sites List in 1ekj
Copper binding site 2 out
of 4 in the The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 2 of The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu1
b:51.9
occ:0.50
|
SG
|
D:CYS166
|
2.4
|
32.0
|
0.5
|
SG
|
C:CYS166
|
2.5
|
35.5
|
0.5
|
NH1
|
C:ARG182
|
3.5
|
23.9
|
1.0
|
OG
|
C:SER168
|
3.6
|
56.8
|
1.0
|
NH1
|
D:ARG182
|
3.7
|
23.6
|
1.0
|
OG
|
D:SER168
|
3.8
|
49.5
|
1.0
|
CB
|
C:CYS166
|
4.1
|
36.5
|
0.5
|
CB
|
D:CYS166
|
4.1
|
31.3
|
0.5
|
CB
|
D:SER168
|
4.1
|
46.6
|
1.0
|
CB
|
C:CYS166
|
4.2
|
40.2
|
0.5
|
CB
|
C:SER168
|
4.2
|
52.9
|
1.0
|
CD
|
D:PRO167
|
4.3
|
33.5
|
1.0
|
N
|
D:SER168
|
4.3
|
42.5
|
1.0
|
CG
|
D:PRO167
|
4.4
|
35.3
|
1.0
|
CB
|
D:CYS166
|
4.4
|
31.4
|
0.5
|
CD
|
C:PRO167
|
4.5
|
42.2
|
1.0
|
CD
|
D:ARG182
|
4.5
|
23.6
|
1.0
|
N
|
C:SER168
|
4.5
|
49.1
|
1.0
|
CD
|
C:ARG182
|
4.5
|
27.9
|
1.0
|
CG
|
C:PRO167
|
4.5
|
44.1
|
1.0
|
N
|
D:PRO167
|
4.6
|
34.6
|
1.0
|
CZ
|
C:ARG182
|
4.6
|
21.4
|
1.0
|
CA
|
C:CYS166
|
4.6
|
39.2
|
0.5
|
CA
|
D:CYS166
|
4.7
|
31.8
|
0.5
|
CA
|
C:CYS166
|
4.7
|
37.0
|
0.5
|
CA
|
D:CYS166
|
4.7
|
32.0
|
0.5
|
N
|
C:PRO167
|
4.8
|
41.8
|
1.0
|
CZ
|
D:ARG182
|
4.8
|
27.6
|
1.0
|
CA
|
D:SER168
|
4.8
|
45.0
|
1.0
|
C
|
D:CYS166
|
4.8
|
33.5
|
0.5
|
C
|
D:CYS166
|
4.9
|
33.4
|
0.5
|
C
|
C:CYS166
|
4.9
|
40.7
|
0.5
|
C
|
C:CYS166
|
4.9
|
39.6
|
0.5
|
|
Copper binding site 3 out
of 4 in 1ekj
Go back to
Copper Binding Sites List in 1ekj
Copper binding site 3 out
of 4 in the The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 3 of The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cu3
b:53.4
occ:0.50
|
O
|
E:HOH1302
|
2.0
|
51.4
|
1.0
|
SG
|
F:CYS166
|
2.3
|
67.9
|
1.0
|
SG
|
E:CYS166
|
2.3
|
63.9
|
1.0
|
NH1
|
F:ARG182
|
3.7
|
39.5
|
1.0
|
OG
|
E:SER168
|
3.7
|
62.3
|
1.0
|
CB
|
E:SER168
|
3.8
|
61.0
|
1.0
|
CB
|
F:CYS166
|
3.8
|
62.0
|
1.0
|
OG
|
F:SER168
|
3.9
|
65.1
|
1.0
|
NH1
|
E:ARG182
|
3.9
|
38.1
|
1.0
|
CB
|
F:SER168
|
3.9
|
63.1
|
1.0
|
CB
|
E:CYS166
|
4.1
|
54.6
|
1.0
|
N
|
E:SER168
|
4.2
|
59.8
|
1.0
|
CD
|
F:PRO167
|
4.3
|
59.7
|
1.0
|
N
|
F:SER168
|
4.3
|
60.7
|
1.0
|
CD
|
E:PRO167
|
4.4
|
56.7
|
1.0
|
CG
|
E:PRO167
|
4.4
|
57.3
|
1.0
|
CG
|
F:PRO167
|
4.4
|
59.2
|
1.0
|
CA
|
F:CYS166
|
4.4
|
60.1
|
1.0
|
N
|
F:PRO167
|
4.6
|
60.0
|
1.0
|
CA
|
E:SER168
|
4.7
|
61.3
|
1.0
|
N
|
E:PRO167
|
4.7
|
55.7
|
1.0
|
CA
|
E:CYS166
|
4.7
|
53.5
|
1.0
|
C
|
F:CYS166
|
4.7
|
60.2
|
1.0
|
CD
|
F:ARG182
|
4.8
|
40.4
|
1.0
|
CA
|
F:SER168
|
4.8
|
62.7
|
1.0
|
CZ
|
F:ARG182
|
4.8
|
37.6
|
1.0
|
CD
|
E:ARG182
|
4.9
|
39.0
|
1.0
|
C
|
E:CYS166
|
4.9
|
54.8
|
1.0
|
|
Copper binding site 4 out
of 4 in 1ekj
Go back to
Copper Binding Sites List in 1ekj
Copper binding site 4 out
of 4 in the The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 4 of The X-Ray Crystallographic Structure of Beta Carbonic Anhydrase From the C3 Dicot Pisum Sativum within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Cu2
b:50.0
occ:0.50
|
O
|
H:HOH1932
|
2.0
|
43.3
|
1.0
|
O
|
G:HOH1935
|
2.0
|
40.7
|
1.0
|
OG
|
G:SER168
|
2.8
|
52.9
|
1.0
|
SG
|
H:CYS166
|
3.2
|
35.7
|
0.5
|
NH1
|
G:ARG182
|
3.4
|
28.1
|
1.0
|
CB
|
G:SER168
|
3.5
|
49.1
|
1.0
|
CD
|
G:PRO167
|
3.6
|
42.3
|
1.0
|
CB
|
G:CYS166
|
3.7
|
45.8
|
0.5
|
N
|
G:SER168
|
3.7
|
46.6
|
1.0
|
CB
|
G:CYS166
|
3.7
|
45.2
|
0.5
|
CA
|
G:CYS166
|
3.9
|
43.5
|
0.5
|
CA
|
G:CYS166
|
3.9
|
43.8
|
0.5
|
CG
|
G:PRO167
|
3.9
|
41.4
|
1.0
|
N
|
G:PRO167
|
3.9
|
43.1
|
1.0
|
OG
|
H:SER168
|
4.0
|
49.9
|
1.0
|
C
|
G:CYS166
|
4.1
|
43.4
|
0.5
|
C
|
G:CYS166
|
4.1
|
43.3
|
0.5
|
CA
|
G:SER168
|
4.2
|
48.9
|
1.0
|
NH1
|
H:ARG182
|
4.3
|
24.3
|
1.0
|
SG
|
G:CYS166
|
4.4
|
52.6
|
0.5
|
CB
|
H:SER168
|
4.4
|
43.1
|
1.0
|
CD
|
G:ARG182
|
4.5
|
30.3
|
1.0
|
CZ
|
G:ARG182
|
4.5
|
28.7
|
1.0
|
CB
|
H:CYS166
|
4.7
|
34.1
|
0.5
|
CB
|
H:CYS166
|
4.7
|
32.7
|
0.5
|
C
|
G:PRO167
|
4.7
|
44.9
|
1.0
|
CA
|
G:PRO167
|
4.8
|
43.2
|
1.0
|
NE
|
G:ARG182
|
4.9
|
27.9
|
1.0
|
O
|
G:CYS166
|
5.0
|
43.0
|
0.5
|
O
|
G:CYS166
|
5.0
|
42.9
|
0.5
|
|
Reference:
M.S.Kimber,
E.F.Pai.
The Active Site Architecture of Pisum Sativum Beta-Carbonic Anhydrase Is A Mirror Image of That of Alpha-Carbonic Anhydrases. Embo J. V. 19 1407 2000.
ISSN: ISSN 0261-4189
PubMed: 10747009
DOI: 10.1093/EMBOJ/19.7.1407
Page generated: Tue Jul 30 21:44:48 2024
|