Calcium in PDB 1f0o: Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site
Enzymatic activity of Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site
All present enzymatic activity of Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site:
3.1.21.4;
Protein crystallography data
The structure of Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site, PDB code: 1f0o
was solved by
J.R.Horton,
X.Cheng,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
30.00 /
2.50
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
94.043,
84.702,
45.993,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
20.5 /
27.9
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site
(pdb code 1f0o). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 4 binding sites of Calcium where determined in the
Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site, PDB code: 1f0o:
Jump to Calcium binding site number:
1;
2;
3;
4;
Calcium binding site 1 out
of 4 in 1f0o
Go back to
Calcium Binding Sites List in 1f0o
Calcium binding site 1 out
of 4 in the Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca701
b:51.6
occ:1.00
|
O
|
A:LEU69
|
2.4
|
15.4
|
1.0
|
OP1
|
D:DC9
|
2.6
|
20.4
|
1.0
|
OE2
|
A:GLU68
|
2.7
|
32.4
|
1.0
|
O
|
A:HOH847
|
2.8
|
20.3
|
1.0
|
OD2
|
A:ASP58
|
3.1
|
28.8
|
1.0
|
CE
|
A:LYS70
|
3.1
|
25.1
|
1.0
|
P
|
D:DC9
|
3.6
|
15.2
|
1.0
|
C
|
A:LEU69
|
3.6
|
15.0
|
1.0
|
CD
|
A:GLU68
|
3.8
|
28.3
|
1.0
|
CD
|
A:LYS70
|
3.8
|
21.9
|
1.0
|
O5'
|
D:DC9
|
3.9
|
14.5
|
1.0
|
C5'
|
D:DC9
|
3.9
|
11.4
|
1.0
|
CG
|
A:ASP58
|
4.0
|
29.2
|
1.0
|
OP2
|
D:DT10
|
4.0
|
22.9
|
1.0
|
O
|
A:HOH839
|
4.1
|
28.8
|
1.0
|
OP2
|
D:DC9
|
4.1
|
15.5
|
1.0
|
CA
|
A:CA784
|
4.2
|
76.5
|
1.0
|
N
|
A:LEU69
|
4.3
|
12.8
|
1.0
|
OD1
|
A:ASP58
|
4.3
|
32.3
|
1.0
|
CG
|
A:LYS70
|
4.3
|
18.6
|
1.0
|
NZ
|
A:LYS70
|
4.3
|
28.7
|
1.0
|
CA
|
A:LEU69
|
4.5
|
13.1
|
1.0
|
N
|
A:LYS70
|
4.5
|
16.5
|
1.0
|
OE1
|
A:GLU68
|
4.5
|
27.4
|
1.0
|
CA
|
A:LYS70
|
4.5
|
17.5
|
1.0
|
O3'
|
D:DC9
|
4.6
|
22.0
|
1.0
|
CG
|
A:GLU68
|
4.6
|
23.6
|
1.0
|
C3'
|
D:DC9
|
4.8
|
19.6
|
1.0
|
P
|
D:DT10
|
4.9
|
21.0
|
1.0
|
C4'
|
D:DC9
|
4.9
|
14.6
|
1.0
|
O3'
|
D:DG8
|
5.0
|
21.1
|
1.0
|
|
Calcium binding site 2 out
of 4 in 1f0o
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Calcium Binding Sites List in 1f0o
Calcium binding site 2 out
of 4 in the Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca784
b:76.5
occ:1.00
|
OP1
|
D:DC9
|
2.6
|
20.4
|
1.0
|
O
|
A:GLY56
|
2.6
|
38.5
|
1.0
|
O
|
D:HOH981
|
2.7
|
46.5
|
1.0
|
OE1
|
A:GLU68
|
3.0
|
27.4
|
1.0
|
OD1
|
A:ASP58
|
3.1
|
32.3
|
1.0
|
OE2
|
A:GLU68
|
3.2
|
32.4
|
1.0
|
P
|
D:DC9
|
3.4
|
15.2
|
1.0
|
OD2
|
A:ASP58
|
3.4
|
28.8
|
1.0
|
O3'
|
D:DG8
|
3.5
|
21.1
|
1.0
|
O
|
A:HOH848
|
3.5
|
40.8
|
1.0
|
CD
|
A:GLU68
|
3.5
|
28.3
|
1.0
|
CG
|
A:ASP58
|
3.6
|
29.2
|
1.0
|
C
|
A:GLY56
|
3.7
|
37.5
|
1.0
|
OP2
|
D:DC9
|
3.8
|
15.5
|
1.0
|
O
|
A:HOH840
|
4.1
|
30.2
|
1.0
|
CA
|
A:CA701
|
4.2
|
51.6
|
1.0
|
N
|
A:GLY56
|
4.4
|
39.8
|
1.0
|
CA
|
A:GLY56
|
4.5
|
38.8
|
1.0
|
C3'
|
D:DG8
|
4.6
|
17.4
|
1.0
|
N
|
A:ASN57
|
4.7
|
35.5
|
1.0
|
N
|
A:ASP58
|
4.7
|
29.1
|
1.0
|
C
|
A:ASN57
|
4.7
|
30.4
|
1.0
|
CA
|
A:ASN57
|
4.8
|
32.2
|
1.0
|
O5'
|
D:DC9
|
4.8
|
14.5
|
1.0
|
CB
|
A:ASP58
|
4.9
|
27.1
|
1.0
|
C5'
|
D:DG8
|
4.9
|
19.1
|
1.0
|
C
|
A:GLU55
|
5.0
|
40.8
|
1.0
|
C4'
|
D:DG8
|
5.0
|
19.3
|
1.0
|
|
Calcium binding site 3 out
of 4 in 1f0o
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Calcium Binding Sites List in 1f0o
Calcium binding site 3 out
of 4 in the Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca725
b:49.3
occ:1.00
|
OP1
|
C:DC9
|
2.3
|
26.0
|
1.0
|
O
|
B:GLY56
|
2.3
|
41.9
|
1.0
|
O
|
C:HOH1028
|
2.5
|
27.1
|
1.0
|
OE1
|
B:GLU68
|
2.7
|
29.2
|
1.0
|
OD1
|
B:ASP58
|
2.8
|
32.6
|
1.0
|
OE2
|
B:GLU68
|
2.9
|
32.2
|
1.0
|
CD
|
B:GLU68
|
3.2
|
30.1
|
1.0
|
OD2
|
B:ASP58
|
3.3
|
35.7
|
1.0
|
O
|
B:GLU55
|
3.4
|
45.7
|
1.0
|
P
|
C:DC9
|
3.4
|
21.8
|
1.0
|
CG
|
B:ASP58
|
3.4
|
34.7
|
1.0
|
C
|
B:GLY56
|
3.5
|
40.4
|
1.0
|
CA
|
B:CA761
|
3.5
|
45.9
|
1.0
|
O3'
|
C:DG8
|
3.8
|
27.8
|
1.0
|
OP2
|
C:DC9
|
3.9
|
26.0
|
1.0
|
CA
|
B:GLY56
|
4.2
|
40.5
|
1.0
|
C
|
B:GLU55
|
4.4
|
43.9
|
1.0
|
N
|
B:ASN57
|
4.5
|
40.3
|
1.0
|
O
|
B:HOH722
|
4.6
|
32.3
|
1.0
|
C
|
B:ASN57
|
4.7
|
37.2
|
1.0
|
CA
|
B:ASN57
|
4.7
|
38.7
|
1.0
|
N
|
B:ASP58
|
4.7
|
36.0
|
1.0
|
CG
|
B:GLU68
|
4.7
|
26.5
|
1.0
|
O5'
|
C:DC9
|
4.7
|
21.6
|
1.0
|
O
|
B:HOH994
|
4.8
|
38.6
|
1.0
|
N
|
B:GLY56
|
4.8
|
42.9
|
1.0
|
CB
|
B:ASP58
|
4.8
|
33.5
|
1.0
|
C3'
|
C:DG8
|
5.0
|
29.2
|
1.0
|
|
Calcium binding site 4 out
of 4 in 1f0o
Go back to
Calcium Binding Sites List in 1f0o
Calcium binding site 4 out
of 4 in the Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Pvuii Endonuclease/Cognate Dna Complex (Glutaraldehyde-Crosslinked Crystal) at pH 7.5 with Two Calcium Ions at Each Active Site within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca761
b:45.9
occ:1.00
|
O
|
B:LEU69
|
2.3
|
21.2
|
1.0
|
OE2
|
B:GLU68
|
2.4
|
32.2
|
1.0
|
O
|
B:HOH762
|
2.4
|
15.1
|
1.0
|
OD2
|
B:ASP58
|
2.6
|
35.7
|
1.0
|
OP1
|
C:DC9
|
2.6
|
26.0
|
1.0
|
O
|
C:HOH898
|
2.8
|
16.0
|
1.0
|
CD
|
B:GLU68
|
3.3
|
30.1
|
1.0
|
C
|
B:LEU69
|
3.4
|
19.4
|
1.0
|
CG
|
B:ASP58
|
3.5
|
34.7
|
1.0
|
CA
|
B:CA725
|
3.5
|
49.3
|
1.0
|
N
|
B:LEU69
|
3.7
|
20.5
|
1.0
|
P
|
C:DC9
|
3.8
|
21.8
|
1.0
|
OD1
|
B:ASP58
|
3.8
|
32.6
|
1.0
|
NZ
|
B:LYS70
|
3.9
|
30.2
|
1.0
|
OE1
|
B:GLU68
|
4.0
|
29.2
|
1.0
|
O5'
|
C:DC9
|
4.0
|
21.6
|
1.0
|
CA
|
B:LEU69
|
4.1
|
19.3
|
1.0
|
CD
|
B:LYS70
|
4.1
|
21.4
|
1.0
|
C5'
|
C:DC9
|
4.1
|
17.3
|
1.0
|
O
|
B:HOH994
|
4.2
|
38.6
|
1.0
|
CE
|
B:LYS70
|
4.3
|
24.7
|
1.0
|
CG
|
B:GLU68
|
4.3
|
26.5
|
1.0
|
O
|
C:HOH906
|
4.4
|
18.7
|
1.0
|
OP2
|
C:DC9
|
4.5
|
26.0
|
1.0
|
N
|
B:LYS70
|
4.5
|
18.4
|
1.0
|
OP2
|
C:DT10
|
4.5
|
22.4
|
1.0
|
CB
|
B:LEU69
|
4.6
|
17.0
|
1.0
|
C
|
B:GLU68
|
4.7
|
23.1
|
1.0
|
CB
|
B:ASP58
|
4.7
|
33.5
|
1.0
|
CA
|
B:LYS70
|
4.8
|
17.2
|
1.0
|
O3'
|
C:DG8
|
5.0
|
27.8
|
1.0
|
CA
|
B:GLU68
|
5.0
|
25.7
|
1.0
|
|
Reference:
J.R.Horton,
X.Cheng.
Pvuii Endonuclease Contains Two Calcium Ions in Active Sites. J.Mol.Biol. V. 300 1049 2000.
ISSN: ISSN 0022-2836
PubMed: 10903853
DOI: 10.1006/JMBI.2000.3938
Page generated: Thu Jul 11 07:59:45 2024
|