Copper in PDB 3nbj: Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
Enzymatic activity of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
All present enzymatic activity of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast:
1.4.3.21;
Protein crystallography data
The structure of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast, PDB code: 3nbj
was solved by
Z.Chen,
S.Datta,
J.L.Dubois,
J.P.Klinman,
F.S.Mathews,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
29.88 /
1.90
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
96.290,
232.470,
104.310,
90.00,
93.68,
90.00
|
R / Rfree (%)
|
21.3 /
21.7
|
Copper Binding Sites:
The binding sites of Copper atom in the Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
(pdb code 3nbj). This binding sites where shown within
5.0 Angstroms radius around Copper atom.
In total 6 binding sites of Copper where determined in the
Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast, PDB code: 3nbj:
Jump to Copper binding site number:
1;
2;
3;
4;
5;
6;
Copper binding site 1 out
of 6 in 3nbj
Go back to
Copper Binding Sites List in 3nbj
Copper binding site 1 out
of 6 in the Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 1 of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cu701
b:22.9
occ:1.00
|
NE2
|
A:HIS458
|
2.1
|
22.4
|
1.0
|
ND1
|
A:HIS624
|
2.1
|
19.4
|
1.0
|
NE2
|
A:HIS456
|
2.1
|
19.3
|
1.0
|
CD2
|
A:HIS458
|
2.9
|
17.6
|
1.0
|
CG
|
A:HIS624
|
3.1
|
19.0
|
1.0
|
O5
|
A:TY9405
|
3.1
|
38.6
|
0.5
|
O5
|
A:TY9405
|
3.1
|
38.6
|
0.5
|
CE1
|
A:HIS456
|
3.1
|
18.3
|
1.0
|
CD2
|
A:HIS456
|
3.1
|
19.8
|
1.0
|
CE1
|
A:HIS624
|
3.2
|
18.8
|
1.0
|
CB
|
A:HIS624
|
3.3
|
15.7
|
1.0
|
CE1
|
A:HIS458
|
3.3
|
20.1
|
1.0
|
C5
|
A:TY9405
|
3.8
|
41.8
|
0.5
|
C5
|
A:TY9405
|
3.8
|
41.8
|
0.5
|
O4
|
A:TY9405
|
3.9
|
51.7
|
0.5
|
O4
|
A:TY9405
|
3.9
|
51.7
|
0.5
|
CG
|
A:HIS458
|
4.1
|
20.6
|
1.0
|
C4
|
A:TY9405
|
4.2
|
44.1
|
0.5
|
C4
|
A:TY9405
|
4.2
|
44.1
|
0.5
|
ND1
|
A:HIS456
|
4.2
|
16.7
|
1.0
|
CG
|
A:HIS456
|
4.2
|
18.4
|
1.0
|
CD2
|
A:HIS624
|
4.3
|
18.6
|
1.0
|
ND1
|
A:HIS458
|
4.3
|
19.4
|
1.0
|
NE2
|
A:HIS624
|
4.3
|
20.3
|
1.0
|
O4A
|
A:TY9405
|
4.4
|
48.8
|
0.5
|
O4A
|
A:TY9405
|
4.4
|
48.8
|
0.5
|
C6
|
A:TY9405
|
4.8
|
38.5
|
0.5
|
C6
|
A:TY9405
|
4.8
|
38.5
|
0.5
|
CA
|
A:HIS624
|
4.8
|
15.9
|
1.0
|
CD1
|
A:LEU425
|
4.8
|
37.3
|
1.0
|
CE
|
A:MET634
|
4.9
|
41.3
|
0.5
|
CE
|
A:MET634
|
4.9
|
41.3
|
0.5
|
CD1
|
A:ILE622
|
5.0
|
28.5
|
1.0
|
|
Copper binding site 2 out
of 6 in 3nbj
Go back to
Copper Binding Sites List in 3nbj
Copper binding site 2 out
of 6 in the Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 2 of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cu701
b:22.9
occ:1.00
|
NE2
|
B:HIS458
|
2.1
|
22.4
|
1.0
|
ND1
|
B:HIS624
|
2.1
|
19.4
|
1.0
|
NE2
|
B:HIS456
|
2.1
|
19.3
|
1.0
|
CD2
|
B:HIS458
|
2.9
|
17.6
|
1.0
|
CG
|
B:HIS624
|
3.1
|
19.0
|
1.0
|
O5
|
B:TY9405
|
3.1
|
38.6
|
0.5
|
O5
|
B:TY9405
|
3.1
|
38.6
|
0.5
|
CE1
|
B:HIS456
|
3.1
|
18.3
|
1.0
|
CD2
|
B:HIS456
|
3.1
|
19.8
|
1.0
|
CE1
|
B:HIS624
|
3.2
|
18.8
|
1.0
|
CB
|
B:HIS624
|
3.3
|
15.7
|
1.0
|
CE1
|
B:HIS458
|
3.3
|
20.1
|
1.0
|
C5
|
B:TY9405
|
3.8
|
41.8
|
0.5
|
C5
|
B:TY9405
|
3.8
|
41.8
|
0.5
|
O4
|
B:TY9405
|
3.9
|
51.7
|
0.5
|
O4
|
B:TY9405
|
3.9
|
51.7
|
0.5
|
CG
|
B:HIS458
|
4.1
|
20.6
|
1.0
|
C4
|
B:TY9405
|
4.2
|
44.1
|
0.5
|
C4
|
B:TY9405
|
4.2
|
44.1
|
0.5
|
ND1
|
B:HIS456
|
4.2
|
16.7
|
1.0
|
CG
|
B:HIS456
|
4.2
|
18.4
|
1.0
|
CD2
|
B:HIS624
|
4.3
|
18.6
|
1.0
|
ND1
|
B:HIS458
|
4.3
|
19.4
|
1.0
|
NE2
|
B:HIS624
|
4.3
|
20.3
|
1.0
|
O4A
|
B:TY9405
|
4.4
|
48.8
|
0.5
|
O4A
|
B:TY9405
|
4.4
|
48.8
|
0.5
|
C6
|
B:TY9405
|
4.8
|
38.5
|
0.5
|
C6
|
B:TY9405
|
4.8
|
38.5
|
0.5
|
CA
|
B:HIS624
|
4.8
|
15.9
|
1.0
|
CD1
|
B:LEU425
|
4.8
|
37.3
|
1.0
|
CE
|
B:MET634
|
4.9
|
41.3
|
0.5
|
CE
|
B:MET634
|
4.9
|
41.3
|
0.5
|
CD1
|
B:ILE622
|
5.0
|
28.5
|
1.0
|
|
Copper binding site 3 out
of 6 in 3nbj
Go back to
Copper Binding Sites List in 3nbj
Copper binding site 3 out
of 6 in the Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 3 of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu701
b:22.9
occ:1.00
|
NE2
|
C:HIS458
|
2.1
|
22.4
|
1.0
|
ND1
|
C:HIS624
|
2.1
|
19.4
|
1.0
|
NE2
|
C:HIS456
|
2.1
|
19.3
|
1.0
|
CD2
|
C:HIS458
|
2.9
|
17.6
|
1.0
|
CG
|
C:HIS624
|
3.1
|
19.0
|
1.0
|
O5
|
C:TY9405
|
3.1
|
38.6
|
0.5
|
O5
|
C:TY9405
|
3.1
|
38.6
|
0.5
|
CE1
|
C:HIS456
|
3.1
|
18.3
|
1.0
|
CD2
|
C:HIS456
|
3.1
|
19.8
|
1.0
|
CE1
|
C:HIS624
|
3.2
|
18.8
|
1.0
|
CB
|
C:HIS624
|
3.2
|
15.7
|
1.0
|
CE1
|
C:HIS458
|
3.3
|
20.1
|
1.0
|
C5
|
C:TY9405
|
3.8
|
41.8
|
0.5
|
C5
|
C:TY9405
|
3.8
|
41.8
|
0.5
|
O4
|
C:TY9405
|
4.0
|
51.7
|
0.5
|
O4
|
C:TY9405
|
4.0
|
51.7
|
0.5
|
CG
|
C:HIS458
|
4.1
|
20.6
|
1.0
|
C4
|
C:TY9405
|
4.2
|
44.1
|
0.5
|
C4
|
C:TY9405
|
4.2
|
44.1
|
0.5
|
ND1
|
C:HIS456
|
4.2
|
16.7
|
1.0
|
CG
|
C:HIS456
|
4.2
|
18.4
|
1.0
|
CD2
|
C:HIS624
|
4.3
|
18.6
|
1.0
|
ND1
|
C:HIS458
|
4.3
|
19.4
|
1.0
|
NE2
|
C:HIS624
|
4.3
|
20.3
|
1.0
|
O4A
|
C:TY9405
|
4.4
|
48.8
|
0.5
|
O4A
|
C:TY9405
|
4.4
|
48.8
|
0.5
|
C6
|
C:TY9405
|
4.8
|
38.5
|
0.5
|
C6
|
C:TY9405
|
4.8
|
38.5
|
0.5
|
CA
|
C:HIS624
|
4.8
|
15.9
|
1.0
|
CD1
|
C:LEU425
|
4.8
|
37.3
|
1.0
|
CE
|
C:MET634
|
4.9
|
41.3
|
0.5
|
CE
|
C:MET634
|
4.9
|
41.3
|
0.5
|
CD1
|
C:ILE622
|
5.0
|
28.5
|
1.0
|
|
Copper binding site 4 out
of 6 in 3nbj
Go back to
Copper Binding Sites List in 3nbj
Copper binding site 4 out
of 6 in the Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 4 of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Cu701
b:22.9
occ:1.00
|
NE2
|
D:HIS458
|
2.1
|
22.4
|
1.0
|
ND1
|
D:HIS624
|
2.1
|
19.4
|
1.0
|
NE2
|
D:HIS456
|
2.1
|
19.3
|
1.0
|
CD2
|
D:HIS458
|
2.9
|
17.6
|
1.0
|
CG
|
D:HIS624
|
3.1
|
19.0
|
1.0
|
O5
|
D:TY9405
|
3.1
|
38.6
|
0.5
|
O5
|
D:TY9405
|
3.1
|
38.6
|
0.5
|
CE1
|
D:HIS456
|
3.1
|
18.3
|
1.0
|
CD2
|
D:HIS456
|
3.1
|
19.8
|
1.0
|
CE1
|
D:HIS624
|
3.2
|
18.8
|
1.0
|
CB
|
D:HIS624
|
3.3
|
15.7
|
1.0
|
CE1
|
D:HIS458
|
3.3
|
20.1
|
1.0
|
C5
|
D:TY9405
|
3.8
|
41.8
|
0.5
|
C5
|
D:TY9405
|
3.8
|
41.8
|
0.5
|
O4
|
D:TY9405
|
3.9
|
51.7
|
0.5
|
O4
|
D:TY9405
|
3.9
|
51.7
|
0.5
|
CG
|
D:HIS458
|
4.1
|
20.6
|
1.0
|
C4
|
D:TY9405
|
4.2
|
44.1
|
0.5
|
C4
|
D:TY9405
|
4.2
|
44.1
|
0.5
|
ND1
|
D:HIS456
|
4.2
|
16.7
|
1.0
|
CG
|
D:HIS456
|
4.2
|
18.4
|
1.0
|
CD2
|
D:HIS624
|
4.3
|
18.6
|
1.0
|
ND1
|
D:HIS458
|
4.3
|
19.4
|
1.0
|
NE2
|
D:HIS624
|
4.3
|
20.3
|
1.0
|
O4A
|
D:TY9405
|
4.4
|
48.8
|
0.5
|
O4A
|
D:TY9405
|
4.4
|
48.8
|
0.5
|
C6
|
D:TY9405
|
4.8
|
38.5
|
0.5
|
C6
|
D:TY9405
|
4.8
|
38.5
|
0.5
|
CA
|
D:HIS624
|
4.8
|
15.9
|
1.0
|
CD1
|
D:LEU425
|
4.8
|
37.3
|
1.0
|
CE
|
D:MET634
|
4.9
|
41.3
|
0.5
|
CE
|
D:MET634
|
4.9
|
41.3
|
0.5
|
CD1
|
D:ILE622
|
5.0
|
28.5
|
1.0
|
|
Copper binding site 5 out
of 6 in 3nbj
Go back to
Copper Binding Sites List in 3nbj
Copper binding site 5 out
of 6 in the Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 5 of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Cu701
b:22.9
occ:1.00
|
NE2
|
E:HIS458
|
2.1
|
22.4
|
1.0
|
ND1
|
E:HIS624
|
2.1
|
19.4
|
1.0
|
NE2
|
E:HIS456
|
2.1
|
19.3
|
1.0
|
CD2
|
E:HIS458
|
2.9
|
17.6
|
1.0
|
CG
|
E:HIS624
|
3.1
|
19.0
|
1.0
|
O5
|
E:TY9405
|
3.1
|
38.6
|
0.5
|
O5
|
E:TY9405
|
3.1
|
38.6
|
0.5
|
CE1
|
E:HIS456
|
3.1
|
18.3
|
1.0
|
CD2
|
E:HIS456
|
3.1
|
19.8
|
1.0
|
CE1
|
E:HIS624
|
3.2
|
18.8
|
1.0
|
CB
|
E:HIS624
|
3.3
|
15.7
|
1.0
|
CE1
|
E:HIS458
|
3.3
|
20.1
|
1.0
|
C5
|
E:TY9405
|
3.8
|
41.8
|
0.5
|
C5
|
E:TY9405
|
3.8
|
41.8
|
0.5
|
O4
|
E:TY9405
|
3.9
|
51.7
|
0.5
|
O4
|
E:TY9405
|
3.9
|
51.7
|
0.5
|
CG
|
E:HIS458
|
4.1
|
20.6
|
1.0
|
C4
|
E:TY9405
|
4.2
|
44.1
|
0.5
|
C4
|
E:TY9405
|
4.2
|
44.1
|
0.5
|
ND1
|
E:HIS456
|
4.2
|
16.7
|
1.0
|
CG
|
E:HIS456
|
4.2
|
18.4
|
1.0
|
CD2
|
E:HIS624
|
4.3
|
18.6
|
1.0
|
ND1
|
E:HIS458
|
4.3
|
19.4
|
1.0
|
NE2
|
E:HIS624
|
4.3
|
20.3
|
1.0
|
O4A
|
E:TY9405
|
4.4
|
48.8
|
0.5
|
O4A
|
E:TY9405
|
4.4
|
48.8
|
0.5
|
C6
|
E:TY9405
|
4.8
|
38.5
|
0.5
|
C6
|
E:TY9405
|
4.8
|
38.5
|
0.5
|
CA
|
E:HIS624
|
4.8
|
15.9
|
1.0
|
CD1
|
E:LEU425
|
4.8
|
37.3
|
1.0
|
CE
|
E:MET634
|
4.9
|
41.3
|
0.5
|
CE
|
E:MET634
|
4.9
|
41.3
|
0.5
|
CD1
|
E:ILE622
|
5.0
|
28.5
|
1.0
|
|
Copper binding site 6 out
of 6 in 3nbj
Go back to
Copper Binding Sites List in 3nbj
Copper binding site 6 out
of 6 in the Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 6 of Crystal Structure of Y305F Mutant of the Copper Amine Oxidase From Hansenula Polymorpha Expressed in Yeast within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Cu701
b:22.9
occ:1.00
|
NE2
|
F:HIS458
|
2.1
|
22.4
|
1.0
|
ND1
|
F:HIS624
|
2.1
|
19.4
|
1.0
|
NE2
|
F:HIS456
|
2.1
|
19.3
|
1.0
|
CD2
|
F:HIS458
|
2.9
|
17.6
|
1.0
|
CG
|
F:HIS624
|
3.1
|
19.0
|
1.0
|
O5
|
F:TY9405
|
3.1
|
38.6
|
0.5
|
O5
|
F:TY9405
|
3.1
|
38.6
|
0.5
|
CE1
|
F:HIS456
|
3.1
|
18.3
|
1.0
|
CD2
|
F:HIS456
|
3.1
|
19.8
|
1.0
|
CE1
|
F:HIS624
|
3.2
|
18.8
|
1.0
|
CB
|
F:HIS624
|
3.3
|
15.7
|
1.0
|
CE1
|
F:HIS458
|
3.3
|
20.1
|
1.0
|
C5
|
F:TY9405
|
3.8
|
41.8
|
0.5
|
C5
|
F:TY9405
|
3.8
|
41.8
|
0.5
|
O4
|
F:TY9405
|
3.9
|
51.7
|
0.5
|
O4
|
F:TY9405
|
3.9
|
51.7
|
0.5
|
CG
|
F:HIS458
|
4.1
|
20.6
|
1.0
|
C4
|
F:TY9405
|
4.2
|
44.1
|
0.5
|
C4
|
F:TY9405
|
4.2
|
44.1
|
0.5
|
ND1
|
F:HIS456
|
4.2
|
16.7
|
1.0
|
CG
|
F:HIS456
|
4.2
|
18.4
|
1.0
|
CD2
|
F:HIS624
|
4.3
|
18.6
|
1.0
|
ND1
|
F:HIS458
|
4.3
|
19.4
|
1.0
|
NE2
|
F:HIS624
|
4.3
|
20.3
|
1.0
|
O4A
|
F:TY9405
|
4.4
|
48.8
|
0.5
|
O4A
|
F:TY9405
|
4.4
|
48.8
|
0.5
|
C6
|
F:TY9405
|
4.8
|
38.5
|
0.5
|
C6
|
F:TY9405
|
4.8
|
38.5
|
0.5
|
CA
|
F:HIS624
|
4.8
|
15.9
|
1.0
|
CD1
|
F:LEU425
|
4.8
|
37.3
|
1.0
|
CE
|
F:MET634
|
4.9
|
41.3
|
0.5
|
CE
|
F:MET634
|
4.9
|
41.3
|
0.5
|
CD1
|
F:ILE622
|
5.0
|
28.5
|
1.0
|
|
Reference:
Z.W.Chen,
S.Datta,
J.L.Dubois,
J.P.Klinman,
F.S.Mathews.
Mutation at A Strictly Conserved, Active Site Tyrosine in the Copper Amine Oxidase Leads to Uncontrolled Oxygenase Activity. Biochemistry V. 49 7393 2010.
ISSN: ISSN 0006-2960
PubMed: 20684524
DOI: 10.1021/BI100643Y
Page generated: Wed Jul 31 01:21:58 2024
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