Copper in PDB 6t5z: Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens
Protein crystallography data
The structure of Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens, PDB code: 6t5z
was solved by
A.Munzone,
B.El Kerdi,
M.Reglier,
A.Royant,
A.J.Simaan,
C.Decroos,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
58.55 /
1.60
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
76.530,
80.390,
90.910,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
18.8 /
21.8
|
Copper Binding Sites:
The binding sites of Copper atom in the Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens
(pdb code 6t5z). 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 An AA10 Lpmo From Photorhabdus Luminescens, PDB code: 6t5z:
Jump to Copper binding site number:
1;
2;
3;
4;
5;
6;
Copper binding site 1 out
of 6 in 6t5z
Go back to
Copper Binding Sites List in 6t5z
Copper binding site 1 out
of 6 in the Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens
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 An AA10 Lpmo From Photorhabdus Luminescens within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cu400
b:16.7
occ:1.00
|
NE2
|
A:HIS115
|
2.0
|
15.6
|
1.0
|
ND1
|
A:HIS26
|
2.0
|
19.5
|
1.0
|
N
|
A:HIS26
|
2.1
|
14.5
|
1.0
|
O
|
A:HOH654
|
2.3
|
16.5
|
0.4
|
O
|
A:HOH575
|
2.4
|
22.7
|
0.4
|
CG
|
A:HIS26
|
2.9
|
19.2
|
1.0
|
CD2
|
A:HIS115
|
3.0
|
15.1
|
1.0
|
CE1
|
A:HIS115
|
3.0
|
17.3
|
1.0
|
CE1
|
A:HIS26
|
3.1
|
19.4
|
1.0
|
CA
|
A:HIS26
|
3.1
|
14.0
|
1.0
|
CB
|
A:HIS26
|
3.2
|
19.1
|
1.0
|
CZ
|
A:PHE188
|
3.6
|
16.5
|
1.0
|
CB
|
A:ILE113
|
3.9
|
18.9
|
1.0
|
O
|
A:HOH736
|
4.0
|
49.1
|
1.0
|
ND1
|
A:HIS115
|
4.1
|
16.9
|
1.0
|
CD2
|
A:HIS26
|
4.1
|
17.9
|
1.0
|
CG
|
A:HIS115
|
4.1
|
15.4
|
1.0
|
CE1
|
A:PHE188
|
4.1
|
15.1
|
1.0
|
NE2
|
A:HIS26
|
4.1
|
19.4
|
1.0
|
O
|
A:ILE113
|
4.1
|
18.1
|
1.0
|
CG2
|
A:ILE113
|
4.2
|
20.3
|
1.0
|
O
|
A:HOH695
|
4.3
|
20.3
|
1.0
|
O
|
A:HOH702
|
4.4
|
39.9
|
1.0
|
CE2
|
A:PHE188
|
4.5
|
17.4
|
1.0
|
C
|
A:HIS26
|
4.5
|
14.1
|
1.0
|
CD1
|
A:ILE113
|
4.5
|
26.7
|
1.0
|
CG1
|
A:ILE113
|
4.7
|
24.6
|
1.0
|
O
|
A:HIS26
|
4.8
|
15.3
|
1.0
|
C
|
A:ILE113
|
4.8
|
16.4
|
1.0
|
CA
|
A:ILE113
|
4.9
|
18.8
|
1.0
|
|
Copper binding site 2 out
of 6 in 6t5z
Go back to
Copper Binding Sites List in 6t5z
Copper binding site 2 out
of 6 in the Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens
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 An AA10 Lpmo From Photorhabdus Luminescens within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cu401
b:30.4
occ:1.00
|
ND1
|
A:HIS83
|
2.1
|
15.5
|
1.0
|
CG
|
A:HIS83
|
3.0
|
15.1
|
1.0
|
CE1
|
A:HIS83
|
3.2
|
16.7
|
1.0
|
CB
|
A:HIS83
|
3.2
|
15.4
|
1.0
|
CD2
|
A:HIS83
|
4.2
|
15.4
|
1.0
|
NE2
|
A:HIS83
|
4.2
|
16.9
|
1.0
|
O
|
A:HOH683
|
4.3
|
19.9
|
1.0
|
CA
|
A:HIS83
|
4.7
|
15.5
|
1.0
|
CD2
|
A:LEU52
|
4.8
|
14.1
|
1.0
|
|
Copper binding site 3 out
of 6 in 6t5z
Go back to
Copper Binding Sites List in 6t5z
Copper binding site 3 out
of 6 in the Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens
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 An AA10 Lpmo From Photorhabdus Luminescens within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cu400
b:16.5
occ:1.00
|
NE2
|
B:HIS115
|
2.0
|
17.9
|
1.0
|
ND1
|
B:HIS26
|
2.1
|
15.2
|
1.0
|
N
|
B:HIS26
|
2.2
|
14.9
|
1.0
|
CE1
|
B:HIS115
|
3.0
|
19.1
|
1.0
|
CD2
|
B:HIS115
|
3.0
|
15.9
|
1.0
|
CG
|
B:HIS26
|
3.0
|
15.9
|
1.0
|
CE1
|
B:HIS26
|
3.1
|
19.5
|
1.0
|
CA
|
B:HIS26
|
3.2
|
15.2
|
1.0
|
CB
|
B:HIS26
|
3.3
|
14.6
|
1.0
|
CZ
|
B:PHE188
|
3.6
|
18.1
|
1.0
|
CB
|
B:ILE113
|
3.9
|
19.4
|
1.0
|
O
|
B:ILE113
|
4.0
|
17.3
|
1.0
|
ND1
|
B:HIS115
|
4.1
|
21.2
|
1.0
|
CG
|
B:HIS115
|
4.1
|
19.0
|
1.0
|
CG2
|
B:ILE113
|
4.2
|
21.4
|
1.0
|
CD2
|
B:HIS26
|
4.2
|
18.5
|
1.0
|
NE2
|
B:HIS26
|
4.2
|
15.0
|
1.0
|
CE1
|
B:PHE188
|
4.2
|
19.2
|
1.0
|
CD1
|
B:ILE113
|
4.4
|
30.9
|
1.0
|
CE2
|
B:PHE188
|
4.4
|
17.2
|
1.0
|
O
|
B:HOH655
|
4.4
|
30.2
|
1.0
|
C
|
B:HIS26
|
4.5
|
16.8
|
1.0
|
CG1
|
B:ILE113
|
4.6
|
27.1
|
1.0
|
C
|
B:ILE113
|
4.7
|
18.2
|
1.0
|
O
|
B:HIS26
|
4.8
|
17.4
|
1.0
|
CA
|
B:ILE113
|
4.9
|
19.3
|
1.0
|
|
Copper binding site 4 out
of 6 in 6t5z
Go back to
Copper Binding Sites List in 6t5z
Copper binding site 4 out
of 6 in the Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens
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 An AA10 Lpmo From Photorhabdus Luminescens within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu400
b:17.3
occ:1.00
|
ND1
|
C:HIS26
|
2.0
|
20.4
|
1.0
|
NE2
|
C:HIS115
|
2.0
|
22.2
|
1.0
|
N
|
C:HIS26
|
2.3
|
15.7
|
1.0
|
CG
|
C:HIS26
|
2.9
|
20.1
|
1.0
|
CE1
|
C:HIS115
|
3.0
|
21.8
|
1.0
|
CE1
|
C:HIS26
|
3.0
|
21.9
|
1.0
|
CD2
|
C:HIS115
|
3.0
|
18.9
|
1.0
|
CA
|
C:HIS26
|
3.2
|
18.0
|
1.0
|
CB
|
C:HIS26
|
3.2
|
18.0
|
1.0
|
CZ
|
C:PHE188
|
3.4
|
18.1
|
1.0
|
CB
|
C:ILE113
|
3.8
|
21.4
|
1.0
|
CG2
|
C:ILE113
|
4.0
|
21.2
|
1.0
|
NE2
|
C:HIS26
|
4.1
|
20.4
|
1.0
|
CD2
|
C:HIS26
|
4.1
|
20.5
|
1.0
|
ND1
|
C:HIS115
|
4.1
|
21.4
|
1.0
|
CE1
|
C:PHE188
|
4.1
|
17.8
|
1.0
|
O
|
C:ILE113
|
4.1
|
19.4
|
1.0
|
CG
|
C:HIS115
|
4.1
|
17.4
|
1.0
|
CE2
|
C:PHE188
|
4.2
|
16.7
|
1.0
|
CD1
|
C:ILE113
|
4.5
|
25.8
|
1.0
|
CG1
|
C:ILE113
|
4.5
|
25.3
|
1.0
|
O
|
C:HOH679
|
4.5
|
10.6
|
0.5
|
C
|
C:HIS26
|
4.5
|
16.5
|
1.0
|
C
|
C:ILE113
|
4.7
|
19.8
|
1.0
|
CA
|
C:ILE113
|
4.8
|
21.1
|
1.0
|
O
|
C:HIS26
|
5.0
|
15.4
|
1.0
|
|
Copper binding site 5 out
of 6 in 6t5z
Go back to
Copper Binding Sites List in 6t5z
Copper binding site 5 out
of 6 in the Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens
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 An AA10 Lpmo From Photorhabdus Luminescens within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu401
b:42.7
occ:0.50
|
O
|
C:HOH664
|
2.2
|
30.8
|
0.6
|
NE2
|
C:HIS83
|
2.2
|
24.7
|
0.5
|
O
|
C:HOH621
|
2.3
|
40.0
|
1.0
|
O
|
C:HOH669
|
2.7
|
44.3
|
1.0
|
CD2
|
C:HIS83
|
3.1
|
24.9
|
0.5
|
CE1
|
C:HIS83
|
3.3
|
25.2
|
0.5
|
O
|
C:HOH603
|
4.2
|
26.3
|
1.0
|
CG
|
C:HIS83
|
4.3
|
23.4
|
0.5
|
ND1
|
C:HIS83
|
4.3
|
23.3
|
0.5
|
|
Copper binding site 6 out
of 6 in 6t5z
Go back to
Copper Binding Sites List in 6t5z
Copper binding site 6 out
of 6 in the Crystal Structure of An AA10 Lpmo From Photorhabdus Luminescens
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 An AA10 Lpmo From Photorhabdus Luminescens within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu402
b:41.0
occ:0.50
|
OE2
|
C:GLU167
|
2.4
|
51.2
|
1.0
|
CD
|
C:GLU167
|
3.4
|
49.6
|
1.0
|
O
|
C:HOH513
|
3.4
|
34.7
|
1.0
|
OE1
|
C:GLU167
|
3.8
|
52.9
|
1.0
|
OE2
|
A:GLU45
|
4.4
|
40.5
|
1.0
|
O
|
A:HOH516
|
4.4
|
40.1
|
1.0
|
CG
|
C:GLU167
|
4.7
|
40.9
|
1.0
|
O
|
A:HOH644
|
4.8
|
44.0
|
1.0
|
OE1
|
A:GLU45
|
4.8
|
41.6
|
1.0
|
|
Reference:
A.Munzone,
B.El Kerdi,
M.Fanuel,
H.Rogniaux,
D.Ropartz,
M.Reglier,
A.Royant,
A.J.Simaan,
C.Decroos.
Characterization of A Bacterial Copper-Dependent Lytic Polysaccharide Monooxygenase with An Unusual Second Coordination Sphere. Febs J. 2020.
ISSN: ISSN 1742-464X
PubMed: 31903721
DOI: 10.1111/FEBS.15203
Page generated: Wed Jul 31 07:31:43 2024
|