Copper in PDB 1mzz: Crystal Structure of Mutant (M182T)of Nitrite Reductase
Enzymatic activity of Crystal Structure of Mutant (M182T)of Nitrite Reductase
All present enzymatic activity of Crystal Structure of Mutant (M182T)of Nitrite Reductase:
1.7.99.3;
Protein crystallography data
The structure of Crystal Structure of Mutant (M182T)of Nitrite Reductase, PDB code: 1mzz
was solved by
H.Guo,
K.Olesen,
Y.Xue,
J.Shapliegh,
L.Sjolin,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
30.00 /
2.00
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
92.495,
123.729,
130.173,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
17 /
21.8
|
Copper Binding Sites:
The binding sites of Copper atom in the Crystal Structure of Mutant (M182T)of Nitrite Reductase
(pdb code 1mzz). 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 Mutant (M182T)of Nitrite Reductase, PDB code: 1mzz:
Jump to Copper binding site number:
1;
2;
3;
4;
5;
6;
Copper binding site 1 out
of 6 in 1mzz
Go back to
Copper Binding Sites List in 1mzz
Copper binding site 1 out
of 6 in the Crystal Structure of Mutant (M182T)of Nitrite Reductase
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 Mutant (M182T)of Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cu401
b:65.3
occ:1.00
|
SG
|
A:CYS167
|
2.4
|
37.0
|
1.0
|
ND1
|
A:HIS177
|
2.4
|
20.9
|
1.0
|
ND1
|
A:HIS126
|
2.6
|
20.0
|
1.0
|
CB
|
A:CYS167
|
3.1
|
25.4
|
1.0
|
CE1
|
A:HIS177
|
3.3
|
21.1
|
1.0
|
CG
|
A:HIS177
|
3.4
|
21.2
|
1.0
|
CE1
|
A:HIS126
|
3.4
|
20.4
|
1.0
|
OG1
|
A:THR182
|
3.5
|
23.7
|
1.0
|
CB
|
A:HIS177
|
3.5
|
21.2
|
1.0
|
CG
|
A:HIS126
|
3.6
|
20.3
|
1.0
|
CB
|
A:HIS126
|
3.8
|
19.9
|
1.0
|
CG
|
A:PRO169
|
4.0
|
29.6
|
1.0
|
CA
|
A:HIS126
|
4.1
|
20.7
|
1.0
|
CG2
|
A:THR182
|
4.1
|
20.4
|
1.0
|
CB
|
A:THR182
|
4.1
|
18.4
|
1.0
|
SD
|
A:MET93
|
4.4
|
34.3
|
1.0
|
O
|
A:PRO125
|
4.4
|
23.6
|
1.0
|
NE2
|
A:HIS177
|
4.5
|
23.3
|
1.0
|
CD2
|
A:HIS177
|
4.5
|
22.3
|
1.0
|
CA
|
A:CYS167
|
4.5
|
22.6
|
1.0
|
NE2
|
A:HIS126
|
4.6
|
19.4
|
1.0
|
CA
|
A:HIS177
|
4.7
|
18.5
|
1.0
|
CD2
|
A:HIS126
|
4.7
|
20.1
|
1.0
|
CD
|
A:PRO169
|
4.7
|
28.7
|
1.0
|
N
|
A:ASN127
|
4.9
|
19.7
|
1.0
|
CB
|
A:MET93
|
4.9
|
24.8
|
1.0
|
|
Copper binding site 2 out
of 6 in 1mzz
Go back to
Copper Binding Sites List in 1mzz
Copper binding site 2 out
of 6 in the Crystal Structure of Mutant (M182T)of Nitrite Reductase
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 Mutant (M182T)of Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cu402
b:20.6
occ:1.00
|
O
|
A:HOH3541
|
1.8
|
26.1
|
1.0
|
NE2
|
B:HIS1338
|
2.0
|
16.0
|
1.0
|
NE2
|
A:HIS131
|
2.0
|
17.0
|
1.0
|
NE2
|
A:HIS166
|
2.1
|
16.7
|
1.0
|
CE1
|
A:HIS131
|
3.0
|
16.0
|
1.0
|
CE1
|
B:HIS1338
|
3.0
|
14.9
|
1.0
|
CE1
|
A:HIS166
|
3.0
|
17.6
|
1.0
|
CD2
|
B:HIS1338
|
3.0
|
16.1
|
1.0
|
CD2
|
A:HIS166
|
3.1
|
18.8
|
1.0
|
CD2
|
A:HIS131
|
3.1
|
14.8
|
1.0
|
OD2
|
A:ASP129
|
3.5
|
25.1
|
1.0
|
NE2
|
B:HIS1287
|
3.8
|
22.9
|
1.0
|
CD2
|
B:HIS1287
|
3.9
|
23.9
|
1.0
|
ND1
|
B:HIS1338
|
4.1
|
14.0
|
1.0
|
ND1
|
A:HIS131
|
4.1
|
14.0
|
1.0
|
ND1
|
A:HIS166
|
4.2
|
18.6
|
1.0
|
CG
|
B:HIS1338
|
4.2
|
16.1
|
1.0
|
CG
|
A:HIS131
|
4.2
|
14.9
|
1.0
|
CG
|
A:HIS166
|
4.3
|
17.9
|
1.0
|
CG
|
A:ASP129
|
4.3
|
22.8
|
1.0
|
CE1
|
B:HIS1287
|
4.5
|
23.2
|
1.0
|
OD1
|
A:ASP129
|
4.6
|
23.1
|
1.0
|
CG
|
B:HIS1287
|
4.9
|
22.6
|
1.0
|
|
Copper binding site 3 out
of 6 in 1mzz
Go back to
Copper Binding Sites List in 1mzz
Copper binding site 3 out
of 6 in the Crystal Structure of Mutant (M182T)of Nitrite Reductase
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 Mutant (M182T)of Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cu1401
b:71.7
occ:1.00
|
ND1
|
B:HIS1126
|
2.4
|
24.5
|
1.0
|
SG
|
B:CYS1167
|
2.5
|
36.8
|
1.0
|
ND1
|
B:HIS1177
|
2.5
|
22.1
|
1.0
|
CE1
|
B:HIS1126
|
3.2
|
22.7
|
1.0
|
CB
|
B:CYS1167
|
3.2
|
25.9
|
1.0
|
CE1
|
B:HIS1177
|
3.3
|
23.9
|
1.0
|
CG
|
B:HIS1177
|
3.4
|
22.6
|
1.0
|
CG
|
B:HIS1126
|
3.4
|
24.0
|
1.0
|
OG1
|
B:THR1182
|
3.6
|
24.5
|
1.0
|
CB
|
B:HIS1177
|
3.7
|
21.1
|
1.0
|
CB
|
B:HIS1126
|
3.8
|
22.8
|
1.0
|
CA
|
B:HIS1126
|
3.9
|
23.3
|
1.0
|
CG
|
B:PRO1169
|
4.0
|
31.5
|
1.0
|
O
|
B:PRO1125
|
4.2
|
25.7
|
1.0
|
CB
|
B:THR1182
|
4.3
|
20.3
|
1.0
|
CG2
|
B:THR1182
|
4.3
|
21.7
|
1.0
|
NE2
|
B:HIS1126
|
4.4
|
22.3
|
1.0
|
NE2
|
B:HIS1177
|
4.4
|
23.4
|
1.0
|
CD2
|
B:HIS1177
|
4.5
|
23.5
|
1.0
|
CD2
|
B:HIS1126
|
4.5
|
23.6
|
1.0
|
SD
|
B:MET1093
|
4.6
|
36.3
|
1.0
|
CD
|
B:PRO1169
|
4.6
|
29.8
|
1.0
|
CA
|
B:CYS1167
|
4.6
|
25.1
|
1.0
|
CA
|
B:HIS1177
|
4.7
|
19.8
|
1.0
|
CB
|
B:MET1093
|
4.8
|
26.7
|
1.0
|
N
|
B:ASN1127
|
5.0
|
21.7
|
1.0
|
|
Copper binding site 4 out
of 6 in 1mzz
Go back to
Copper Binding Sites List in 1mzz
Copper binding site 4 out
of 6 in the Crystal Structure of Mutant (M182T)of Nitrite Reductase
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 Mutant (M182T)of Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cu1402
b:21.1
occ:1.00
|
O
|
B:HOH3542
|
1.9
|
40.5
|
1.0
|
NE2
|
B:HIS1131
|
2.0
|
14.5
|
1.0
|
NE2
|
C:HIS2338
|
2.0
|
15.8
|
1.0
|
NE2
|
B:HIS1166
|
2.0
|
16.0
|
1.0
|
CE1
|
C:HIS2338
|
2.9
|
16.1
|
1.0
|
CE1
|
B:HIS1131
|
2.9
|
14.9
|
1.0
|
CD2
|
B:HIS1166
|
3.0
|
16.2
|
1.0
|
CD2
|
C:HIS2338
|
3.0
|
17.2
|
1.0
|
CD2
|
B:HIS1131
|
3.1
|
14.3
|
1.0
|
CE1
|
B:HIS1166
|
3.1
|
16.1
|
1.0
|
OD2
|
B:ASP1129
|
3.7
|
25.8
|
1.0
|
NE2
|
C:HIS2287
|
3.8
|
22.9
|
1.0
|
CD2
|
C:HIS2287
|
4.1
|
23.0
|
1.0
|
ND1
|
B:HIS1131
|
4.1
|
13.8
|
1.0
|
ND1
|
C:HIS2338
|
4.1
|
15.8
|
1.0
|
CG
|
B:HIS1131
|
4.2
|
15.1
|
1.0
|
CG
|
C:HIS2338
|
4.2
|
15.4
|
1.0
|
CG
|
B:HIS1166
|
4.2
|
17.9
|
1.0
|
ND1
|
B:HIS1166
|
4.2
|
17.2
|
1.0
|
CG
|
B:ASP1129
|
4.4
|
23.8
|
1.0
|
CE1
|
C:HIS2287
|
4.5
|
22.5
|
1.0
|
OD1
|
B:ASP1129
|
4.7
|
22.5
|
1.0
|
O
|
B:HOH3130
|
5.0
|
20.3
|
1.0
|
CG
|
C:HIS2287
|
5.0
|
21.9
|
1.0
|
|
Copper binding site 5 out
of 6 in 1mzz
Go back to
Copper Binding Sites List in 1mzz
Copper binding site 5 out
of 6 in the Crystal Structure of Mutant (M182T)of Nitrite Reductase
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 Mutant (M182T)of Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu2401
b:63.9
occ:1.00
|
SG
|
C:CYS2167
|
2.4
|
38.6
|
1.0
|
ND1
|
C:HIS2177
|
2.4
|
22.1
|
1.0
|
ND1
|
C:HIS2126
|
2.6
|
20.3
|
1.0
|
CB
|
C:CYS2167
|
3.2
|
25.8
|
1.0
|
CE1
|
C:HIS2177
|
3.3
|
23.1
|
1.0
|
CG
|
C:HIS2177
|
3.3
|
21.6
|
1.0
|
CE1
|
C:HIS2126
|
3.3
|
20.4
|
1.0
|
OG1
|
C:THR2182
|
3.4
|
20.8
|
1.0
|
CB
|
C:HIS2177
|
3.6
|
19.3
|
1.0
|
CG
|
C:HIS2126
|
3.6
|
20.4
|
1.0
|
CB
|
C:HIS2126
|
3.9
|
20.5
|
1.0
|
CG
|
C:PRO2169
|
4.0
|
30.4
|
1.0
|
CA
|
C:HIS2126
|
4.1
|
21.2
|
1.0
|
SD
|
C:MET2093
|
4.2
|
24.7
|
1.0
|
CG2
|
C:THR2182
|
4.2
|
20.5
|
1.0
|
CB
|
C:THR2182
|
4.2
|
16.6
|
1.0
|
NE2
|
C:HIS2177
|
4.4
|
24.0
|
1.0
|
CD2
|
C:HIS2177
|
4.4
|
23.3
|
1.0
|
CA
|
C:CYS2167
|
4.5
|
25.4
|
1.0
|
O
|
C:PRO2125
|
4.5
|
24.6
|
1.0
|
NE2
|
C:HIS2126
|
4.5
|
19.7
|
1.0
|
CB
|
C:MET2093
|
4.6
|
23.5
|
1.0
|
CA
|
C:HIS2177
|
4.7
|
17.8
|
1.0
|
CD2
|
C:HIS2126
|
4.7
|
20.0
|
1.0
|
CD
|
C:PRO2169
|
4.7
|
29.2
|
1.0
|
N
|
C:ASN2127
|
4.9
|
20.9
|
1.0
|
|
Copper binding site 6 out
of 6 in 1mzz
Go back to
Copper Binding Sites List in 1mzz
Copper binding site 6 out
of 6 in the Crystal Structure of Mutant (M182T)of Nitrite Reductase
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 Mutant (M182T)of Nitrite Reductase within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Cu2402
b:20.8
occ:1.00
|
O
|
C:HOH3543
|
1.8
|
34.9
|
1.0
|
NE2
|
C:HIS2166
|
2.0
|
14.8
|
1.0
|
NE2
|
A:HIS338
|
2.1
|
12.9
|
1.0
|
NE2
|
C:HIS2131
|
2.1
|
13.5
|
1.0
|
CE1
|
A:HIS338
|
3.0
|
14.9
|
1.0
|
CE1
|
C:HIS2131
|
3.0
|
15.3
|
1.0
|
CD2
|
C:HIS2166
|
3.0
|
15.9
|
1.0
|
CD2
|
A:HIS338
|
3.1
|
13.6
|
1.0
|
CE1
|
C:HIS2166
|
3.1
|
16.8
|
1.0
|
CD2
|
C:HIS2131
|
3.2
|
14.6
|
1.0
|
OD2
|
C:ASP2129
|
3.6
|
25.5
|
1.0
|
NE2
|
A:HIS287
|
3.9
|
25.2
|
1.0
|
ND1
|
C:HIS2131
|
4.1
|
14.3
|
1.0
|
CD2
|
A:HIS287
|
4.2
|
24.9
|
1.0
|
ND1
|
A:HIS338
|
4.2
|
12.9
|
1.0
|
CG
|
C:HIS2166
|
4.2
|
16.6
|
1.0
|
CG
|
A:HIS338
|
4.2
|
14.4
|
1.0
|
ND1
|
C:HIS2166
|
4.3
|
16.2
|
1.0
|
CG
|
C:HIS2131
|
4.3
|
14.4
|
1.0
|
CG
|
C:ASP2129
|
4.3
|
23.9
|
1.0
|
CE1
|
A:HIS287
|
4.5
|
23.7
|
1.0
|
OD1
|
C:ASP2129
|
4.7
|
25.6
|
1.0
|
CG
|
A:HIS287
|
4.9
|
23.5
|
1.0
|
O
|
C:HOH3173
|
5.0
|
21.3
|
1.0
|
CD1
|
A:ILE289
|
5.0
|
20.6
|
1.0
|
ND1
|
A:HIS287
|
5.0
|
24.4
|
1.0
|
|
Reference:
H.Guo,
K.Olesen,
Y.Xue,
J.Shapliegh,
L.Sjolin.
The High Resolution Crystal Structures of Nitrite Reductase and Its Mutant MET182THR From Rhodobacter Sphaeroides Reveal A Gating Mechanism For the Electron Transfer to the Type 1 Copper Center To Be Published.
Page generated: Tue Jul 30 22:22:28 2024
|