Copper in PDB 1snr: Nitric Oxide Bound to Cu Nitrite Reductase
Enzymatic activity of Nitric Oxide Bound to Cu Nitrite Reductase
All present enzymatic activity of Nitric Oxide Bound to Cu Nitrite Reductase:
1.7.2.1;
Protein crystallography data
The structure of Nitric Oxide Bound to Cu Nitrite Reductase, PDB code: 1snr
was solved by
E.I.Tocheva,
F.I.Rosell,
A.G.Mauk,
M.E.Murphy,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
34.30 /
1.31
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
61.726,
102.595,
145.652,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
12.4 /
14.1
|
Copper Binding Sites:
The binding sites of Copper atom in the Nitric Oxide Bound to Cu Nitrite Reductase
(pdb code 1snr). This binding sites where shown within
5.0 Angstroms radius around Copper atom.
In total 6 binding sites of Copper where determined in the
Nitric Oxide Bound to Cu Nitrite Reductase, PDB code: 1snr:
Jump to Copper binding site number:
1;
2;
3;
4;
5;
6;
Copper binding site 1 out
of 6 in 1snr
Go back to
Copper Binding Sites List in 1snr
Copper binding site 1 out
of 6 in the Nitric Oxide Bound to Cu Nitrite Reductase
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 1 of Nitric Oxide Bound to Cu Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cu501
b:10.0
occ:1.00
|
ND1
|
A:HIS145
|
2.1
|
9.8
|
1.0
|
ND1
|
A:HIS95
|
2.1
|
9.4
|
1.0
|
SG
|
A:CYS136
|
2.2
|
9.7
|
1.0
|
SD
|
A:MET150
|
2.4
|
9.9
|
1.0
|
CE1
|
A:HIS145
|
3.0
|
10.4
|
1.0
|
CE1
|
A:HIS95
|
3.0
|
10.3
|
1.0
|
CG
|
A:HIS95
|
3.1
|
10.1
|
1.0
|
CG
|
A:HIS145
|
3.1
|
9.2
|
1.0
|
CB
|
A:CYS136
|
3.2
|
8.9
|
1.0
|
CE
|
A:MET150
|
3.2
|
10.1
|
1.0
|
CB
|
A:HIS95
|
3.5
|
9.4
|
1.0
|
CB
|
A:HIS145
|
3.5
|
8.9
|
1.0
|
CG
|
A:MET150
|
3.8
|
8.9
|
1.0
|
CA
|
A:HIS95
|
3.8
|
9.3
|
1.0
|
NE2
|
A:HIS145
|
4.1
|
10.3
|
1.0
|
NE2
|
A:HIS95
|
4.1
|
10.7
|
1.0
|
CD2
|
A:HIS95
|
4.2
|
12.8
|
1.0
|
CD2
|
A:HIS145
|
4.2
|
11.5
|
1.0
|
CB
|
A:MET150
|
4.3
|
8.8
|
1.0
|
CG
|
A:PRO138
|
4.3
|
10.7
|
1.0
|
O
|
A:MET94
|
4.3
|
9.4
|
1.0
|
SD
|
A:MET62
|
4.4
|
11.9
|
1.0
|
CA
|
A:CYS136
|
4.6
|
8.5
|
1.0
|
CD
|
A:PRO138
|
4.7
|
9.2
|
1.0
|
N
|
A:ASN96
|
4.7
|
9.0
|
1.0
|
CB
|
A:MET62
|
4.7
|
11.1
|
1.0
|
CA
|
A:HIS145
|
4.8
|
8.6
|
1.0
|
C
|
A:HIS95
|
4.8
|
8.9
|
1.0
|
N
|
A:HIS95
|
4.9
|
9.2
|
1.0
|
|
Copper binding site 2 out
of 6 in 1snr
Go back to
Copper Binding Sites List in 1snr
Copper binding site 2 out
of 6 in the Nitric Oxide Bound to Cu Nitrite Reductase
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 2 of Nitric Oxide Bound to Cu Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cu502
b:9.9
occ:1.00
|
O
|
A:NO503
|
1.9
|
25.9
|
1.0
|
N
|
A:NO503
|
2.0
|
23.4
|
1.0
|
NE2
|
A:HIS100
|
2.0
|
9.2
|
1.0
|
NE2
|
B:HIS306
|
2.0
|
8.5
|
1.0
|
NE2
|
A:HIS135
|
2.1
|
8.1
|
1.0
|
CE1
|
A:HIS100
|
2.9
|
8.0
|
1.0
|
CE1
|
B:HIS306
|
3.0
|
8.2
|
1.0
|
CD2
|
A:HIS135
|
3.1
|
8.0
|
1.0
|
CD2
|
B:HIS306
|
3.1
|
9.2
|
1.0
|
CD2
|
A:HIS100
|
3.1
|
7.8
|
1.0
|
CE1
|
A:HIS135
|
3.1
|
7.9
|
1.0
|
OD1
|
A:ASP98
|
3.7
|
18.5
|
1.0
|
NE2
|
B:HIS255
|
4.0
|
14.4
|
1.0
|
ND1
|
A:HIS100
|
4.1
|
8.2
|
1.0
|
ND1
|
B:HIS306
|
4.1
|
8.0
|
1.0
|
CG
|
A:HIS100
|
4.2
|
7.8
|
1.0
|
CE1
|
B:HIS255
|
4.2
|
13.7
|
1.0
|
ND1
|
A:HIS135
|
4.2
|
8.0
|
1.0
|
CG
|
B:HIS306
|
4.2
|
8.2
|
1.0
|
CG
|
A:HIS135
|
4.2
|
7.7
|
1.0
|
CG
|
A:ASP98
|
4.4
|
13.8
|
1.0
|
CD2
|
B:HIS255
|
4.5
|
12.5
|
1.0
|
OD2
|
A:ASP98
|
4.7
|
15.6
|
1.0
|
ND1
|
B:HIS255
|
4.7
|
12.2
|
1.0
|
CD2
|
B:LEU308
|
4.9
|
9.9
|
1.0
|
O
|
B:HOH1726
|
4.9
|
16.6
|
1.0
|
CG
|
B:HIS255
|
4.9
|
9.9
|
1.0
|
|
Copper binding site 3 out
of 6 in 1snr
Go back to
Copper Binding Sites List in 1snr
Copper binding site 3 out
of 6 in the Nitric Oxide Bound to Cu Nitrite Reductase
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 3 of Nitric Oxide Bound to Cu Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cu501
b:12.1
occ:1.00
|
ND1
|
B:HIS95
|
2.1
|
11.0
|
1.0
|
ND1
|
B:HIS145
|
2.1
|
11.2
|
1.0
|
SG
|
B:CYS136
|
2.2
|
11.9
|
1.0
|
SD
|
B:MET150
|
2.5
|
11.5
|
1.0
|
CE1
|
B:HIS145
|
3.0
|
12.2
|
1.0
|
CE1
|
B:HIS95
|
3.0
|
11.3
|
1.0
|
CG
|
B:HIS95
|
3.1
|
11.6
|
1.0
|
CG
|
B:HIS145
|
3.1
|
11.0
|
1.0
|
CB
|
B:CYS136
|
3.2
|
10.8
|
1.0
|
CE
|
B:MET150
|
3.3
|
11.1
|
1.0
|
CB
|
B:HIS95
|
3.5
|
11.8
|
1.0
|
CB
|
B:HIS145
|
3.5
|
10.5
|
1.0
|
CA
|
B:HIS95
|
3.8
|
12.1
|
1.0
|
CG
|
B:MET150
|
3.9
|
10.2
|
1.0
|
NE2
|
B:HIS145
|
4.1
|
12.5
|
1.0
|
NE2
|
B:HIS95
|
4.1
|
11.3
|
1.0
|
CG
|
B:PRO138
|
4.2
|
12.9
|
1.0
|
CD2
|
B:HIS145
|
4.2
|
12.2
|
1.0
|
CD2
|
B:HIS95
|
4.2
|
11.9
|
1.0
|
O
|
B:MET94
|
4.3
|
12.3
|
1.0
|
SD
|
B:MET62
|
4.4
|
13.8
|
1.0
|
CB
|
B:MET150
|
4.4
|
9.7
|
1.0
|
CD
|
B:PRO138
|
4.5
|
11.7
|
1.0
|
CA
|
B:CYS136
|
4.6
|
10.4
|
1.0
|
N
|
B:ASN96
|
4.7
|
11.4
|
1.0
|
CA
|
B:HIS145
|
4.8
|
10.6
|
1.0
|
C
|
B:HIS95
|
4.8
|
11.9
|
1.0
|
N
|
B:HIS95
|
4.8
|
12.2
|
1.0
|
CB
|
B:MET62
|
4.8
|
11.1
|
1.0
|
C
|
B:MET94
|
5.0
|
12.0
|
1.0
|
|
Copper binding site 4 out
of 6 in 1snr
Go back to
Copper Binding Sites List in 1snr
Copper binding site 4 out
of 6 in the Nitric Oxide Bound to Cu Nitrite Reductase
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 4 of Nitric Oxide Bound to Cu Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cu502
b:11.5
occ:1.00
|
N
|
B:NO503
|
2.0
|
26.3
|
1.0
|
NE2
|
B:HIS100
|
2.0
|
10.4
|
1.0
|
NE2
|
B:HIS135
|
2.1
|
10.4
|
1.0
|
NE2
|
C:HIS306
|
2.1
|
10.1
|
1.0
|
O
|
B:NO503
|
2.1
|
27.2
|
1.0
|
CE1
|
B:HIS100
|
3.0
|
10.3
|
1.0
|
CD2
|
B:HIS135
|
3.0
|
10.3
|
1.0
|
CE1
|
C:HIS306
|
3.0
|
10.1
|
1.0
|
CE1
|
B:HIS135
|
3.1
|
9.5
|
1.0
|
CD2
|
C:HIS306
|
3.1
|
10.5
|
1.0
|
CD2
|
B:HIS100
|
3.1
|
10.2
|
1.0
|
OD1
|
B:ASP98
|
3.7
|
20.4
|
1.0
|
NE2
|
C:HIS255
|
4.0
|
15.8
|
1.0
|
ND1
|
B:HIS100
|
4.1
|
10.1
|
1.0
|
ND1
|
C:HIS306
|
4.2
|
9.4
|
1.0
|
ND1
|
B:HIS135
|
4.2
|
10.0
|
1.0
|
CG
|
B:HIS135
|
4.2
|
9.8
|
1.0
|
CG
|
B:HIS100
|
4.2
|
10.3
|
1.0
|
CG
|
C:HIS306
|
4.2
|
9.8
|
1.0
|
CE1
|
C:HIS255
|
4.2
|
16.0
|
1.0
|
CG
|
B:ASP98
|
4.3
|
15.4
|
1.0
|
CD2
|
C:HIS255
|
4.5
|
15.1
|
1.0
|
OD2
|
B:ASP98
|
4.7
|
17.5
|
1.0
|
ND1
|
C:HIS255
|
4.7
|
14.0
|
1.0
|
O
|
C:HOH1700
|
4.9
|
17.7
|
1.0
|
CG
|
C:HIS255
|
4.9
|
11.2
|
1.0
|
CD2
|
C:LEU308
|
5.0
|
12.7
|
1.0
|
|
Copper binding site 5 out
of 6 in 1snr
Go back to
Copper Binding Sites List in 1snr
Copper binding site 5 out
of 6 in the Nitric Oxide Bound to Cu Nitrite Reductase
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 5 of Nitric Oxide Bound to Cu Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu501
b:15.2
occ:1.00
|
ND1
|
C:HIS95
|
2.1
|
15.7
|
1.0
|
ND1
|
C:HIS145
|
2.1
|
14.6
|
1.0
|
SG
|
C:CYS136
|
2.2
|
14.6
|
1.0
|
SD
|
C:MET150
|
2.5
|
14.5
|
1.0
|
CE1
|
C:HIS145
|
3.0
|
15.2
|
1.0
|
CE1
|
C:HIS95
|
3.0
|
14.0
|
1.0
|
CG
|
C:HIS95
|
3.1
|
14.8
|
1.0
|
CG
|
C:HIS145
|
3.2
|
13.6
|
1.0
|
CB
|
C:CYS136
|
3.2
|
13.7
|
1.0
|
CE
|
C:MET150
|
3.3
|
15.1
|
1.0
|
CB
|
C:HIS95
|
3.5
|
15.0
|
1.0
|
CB
|
C:HIS145
|
3.6
|
13.0
|
1.0
|
CA
|
C:HIS95
|
3.8
|
14.6
|
1.0
|
CG
|
C:MET150
|
3.9
|
13.6
|
1.0
|
NE2
|
C:HIS95
|
4.1
|
15.0
|
1.0
|
NE2
|
C:HIS145
|
4.1
|
15.2
|
1.0
|
CD2
|
C:HIS95
|
4.2
|
15.7
|
1.0
|
CG
|
C:PRO138
|
4.2
|
14.9
|
1.0
|
CD2
|
C:HIS145
|
4.2
|
14.3
|
1.0
|
O
|
C:MET94
|
4.3
|
16.1
|
1.0
|
CB
|
C:MET150
|
4.4
|
12.5
|
1.0
|
SD
|
C:MET62
|
4.5
|
15.6
|
1.0
|
CD
|
C:PRO138
|
4.6
|
13.9
|
1.0
|
CA
|
C:CYS136
|
4.6
|
13.1
|
1.0
|
N
|
C:ASN96
|
4.6
|
14.2
|
1.0
|
CB
|
C:MET62
|
4.8
|
14.3
|
1.0
|
CA
|
C:HIS145
|
4.8
|
12.6
|
1.0
|
C
|
C:HIS95
|
4.8
|
14.5
|
1.0
|
N
|
C:HIS95
|
4.8
|
14.9
|
1.0
|
C
|
C:MET94
|
5.0
|
15.5
|
1.0
|
|
Copper binding site 6 out
of 6 in 1snr
Go back to
Copper Binding Sites List in 1snr
Copper binding site 6 out
of 6 in the Nitric Oxide Bound to Cu Nitrite Reductase
Mono view
Stereo pair view
|
A full contact list of Copper with other atoms in the Cu binding
site number 6 of Nitric Oxide Bound to Cu Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu502
b:12.9
occ:1.00
|
N
|
C:NO503
|
2.0
|
24.6
|
1.0
|
O
|
C:NO503
|
2.0
|
26.0
|
1.0
|
NE2
|
C:HIS100
|
2.0
|
10.9
|
1.0
|
NE2
|
C:HIS135
|
2.0
|
12.4
|
1.0
|
NE2
|
A:HIS306
|
2.1
|
10.2
|
1.0
|
CE1
|
C:HIS100
|
2.9
|
11.1
|
1.0
|
CD2
|
C:HIS135
|
3.0
|
12.8
|
1.0
|
CE1
|
A:HIS306
|
3.0
|
11.0
|
1.0
|
CE1
|
C:HIS135
|
3.1
|
12.1
|
1.0
|
CD2
|
A:HIS306
|
3.1
|
10.6
|
1.0
|
CD2
|
C:HIS100
|
3.1
|
11.0
|
1.0
|
OD1
|
C:ASP98
|
3.8
|
23.2
|
1.0
|
NE2
|
A:HIS255
|
4.0
|
16.4
|
1.0
|
ND1
|
C:HIS100
|
4.1
|
11.2
|
1.0
|
ND1
|
A:HIS306
|
4.1
|
10.9
|
1.0
|
ND1
|
C:HIS135
|
4.2
|
12.0
|
1.0
|
CG
|
C:HIS135
|
4.2
|
12.6
|
1.0
|
CG
|
C:HIS100
|
4.2
|
10.7
|
1.0
|
CE1
|
A:HIS255
|
4.2
|
16.9
|
1.0
|
CG
|
A:HIS306
|
4.2
|
10.6
|
1.0
|
CG
|
C:ASP98
|
4.4
|
18.1
|
1.0
|
CD2
|
A:HIS255
|
4.5
|
15.2
|
1.0
|
OD2
|
C:ASP98
|
4.7
|
19.3
|
1.0
|
ND1
|
A:HIS255
|
4.7
|
14.6
|
1.0
|
CG
|
A:HIS255
|
4.9
|
11.5
|
1.0
|
O
|
A:HOH1750
|
4.9
|
19.8
|
1.0
|
CD2
|
A:LEU308
|
4.9
|
11.8
|
1.0
|
|
Reference:
E.I.Tocheva,
F.I.Rosell,
A.G.Mauk,
M.E.Murphy.
Side-on Copper-Nitrosyl Coordination By Nitrite Reductase. Science V. 304 867 2004.
ISSN: ISSN 0036-8075
PubMed: 15131305
DOI: 10.1126/SCIENCE.1095109
Page generated: Tue Jul 30 22:47:04 2024
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