Chlorine in PDB 3kzw: Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
Enzymatic activity of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
All present enzymatic activity of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col:
3.4.11.1;
Protein crystallography data
The structure of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col, PDB code: 3kzw
was solved by
J.Hattne,
I.Dubrovska,
A.Halavaty,
G.Minasov,
P.Scott,
L.Shuvalova,
J.Winsor,
Z.Otwinowski,
Center For Structural Genomics Of Infectiousdiseases (Csgid),
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
44.62 /
2.70
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
143.383,
154.733,
340.101,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
22.1 /
24
|
Other elements in 3kzw:
The structure of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col also contains other interesting chemical elements:
Chlorine Binding Sites:
Chlorine binding site 1 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 1 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl492
b:31.7
occ:1.00
|
N
|
A:LEU79
|
3.2
|
2.7
|
1.0
|
N
|
A:HIS23
|
3.5
|
11.7
|
1.0
|
CG
|
A:LEU79
|
3.6
|
2.7
|
1.0
|
CB
|
A:LEU79
|
3.6
|
2.7
|
1.0
|
CB
|
A:PRO21
|
3.7
|
9.4
|
1.0
|
O
|
A:HIS23
|
3.8
|
12.6
|
1.0
|
N
|
A:GLU22
|
3.8
|
10.3
|
1.0
|
CD1
|
A:LEU79
|
3.8
|
2.7
|
1.0
|
CG
|
A:GLN26
|
3.9
|
16.9
|
1.0
|
O
|
A:GLY77
|
3.9
|
2.6
|
1.0
|
CA
|
A:ASN78
|
4.0
|
2.7
|
1.0
|
CA
|
A:LEU79
|
4.0
|
2.7
|
1.0
|
CB
|
A:GLN26
|
4.0
|
16.5
|
1.0
|
C
|
A:ASN78
|
4.1
|
2.7
|
1.0
|
OD1
|
A:ASN78
|
4.2
|
2.8
|
1.0
|
CB
|
A:HIS23
|
4.2
|
12.1
|
1.0
|
CA
|
A:HIS23
|
4.2
|
12.2
|
1.0
|
CB
|
A:GLU22
|
4.3
|
10.9
|
1.0
|
CA
|
A:GLU22
|
4.4
|
10.9
|
1.0
|
C
|
A:HIS23
|
4.4
|
12.6
|
1.0
|
C
|
A:GLU22
|
4.4
|
11.2
|
1.0
|
CD2
|
A:HIS23
|
4.4
|
11.9
|
1.0
|
C
|
A:PRO21
|
4.5
|
9.8
|
1.0
|
CG
|
A:ASN78
|
4.6
|
2.7
|
1.0
|
CA
|
A:PRO21
|
4.6
|
9.4
|
1.0
|
CG
|
A:PRO21
|
4.7
|
9.3
|
1.0
|
CG
|
A:HIS23
|
4.7
|
12.0
|
1.0
|
C
|
A:GLY77
|
4.8
|
2.6
|
1.0
|
N
|
A:ASN78
|
4.9
|
2.6
|
1.0
|
CB
|
A:ASN78
|
4.9
|
2.7
|
1.0
|
CD
|
A:GLN26
|
5.0
|
17.5
|
1.0
|
CD2
|
A:LEU79
|
5.0
|
2.7
|
1.0
|
|
Chlorine binding site 2 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 2 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl493
b:41.3
occ:1.00
|
O
|
A:HOH605
|
3.7
|
10.0
|
1.0
|
OG1
|
A:THR328
|
3.8
|
2.7
|
1.0
|
O
|
A:VAL326
|
4.2
|
2.6
|
1.0
|
N
|
A:THR328
|
4.7
|
2.7
|
1.0
|
CE1
|
B:TYR141
|
4.9
|
2.6
|
1.0
|
CA
|
A:PHE327
|
4.9
|
2.6
|
1.0
|
CB
|
A:THR328
|
5.0
|
2.6
|
1.0
|
CG2
|
B:VAL189
|
5.0
|
2.6
|
1.0
|
|
Chlorine binding site 3 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 3 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl494
b:57.9
occ:1.00
|
OE1
|
A:GLU333
|
4.2
|
2.9
|
1.0
|
CD
|
A:GLU333
|
4.5
|
2.9
|
1.0
|
O
|
A:HIS447
|
4.6
|
2.7
|
1.0
|
NE2
|
A:HIS447
|
4.6
|
2.6
|
1.0
|
OE2
|
A:GLU333
|
4.6
|
2.8
|
1.0
|
CE1
|
A:PHE353
|
4.9
|
2.6
|
1.0
|
|
Chlorine binding site 4 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 4 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl495
b:17.4
occ:1.00
|
NE
|
A:ARG345
|
2.9
|
2.6
|
1.0
|
N
|
A:ARG345
|
3.2
|
2.6
|
1.0
|
N
|
A:GLY344
|
3.4
|
2.7
|
1.0
|
NH2
|
A:ARG345
|
3.5
|
2.5
|
1.0
|
C
|
A:ALA342
|
3.5
|
2.7
|
1.0
|
CA
|
A:ALA342
|
3.5
|
2.6
|
1.0
|
CD2
|
A:LEU369
|
3.6
|
2.7
|
1.0
|
CZ
|
A:ARG345
|
3.6
|
2.6
|
1.0
|
CG
|
A:ARG345
|
3.7
|
2.6
|
1.0
|
CA
|
A:GLY344
|
3.7
|
2.7
|
1.0
|
O
|
A:ALA342
|
3.8
|
2.7
|
1.0
|
CB
|
A:ARG345
|
3.9
|
2.6
|
1.0
|
CD
|
A:ARG345
|
3.9
|
2.6
|
1.0
|
N
|
A:GLU343
|
3.9
|
2.7
|
1.0
|
C
|
A:GLY344
|
3.9
|
2.7
|
1.0
|
CB
|
A:ALA342
|
4.0
|
2.6
|
1.0
|
CA
|
A:ARG345
|
4.1
|
2.6
|
1.0
|
C
|
A:GLU343
|
4.3
|
2.8
|
1.0
|
CD1
|
A:LEU369
|
4.4
|
2.7
|
1.0
|
CG
|
A:LEU369
|
4.4
|
2.8
|
1.0
|
O
|
A:LEU369
|
4.5
|
2.8
|
1.0
|
O
|
A:ASP341
|
4.6
|
2.7
|
1.0
|
CB
|
A:LEU369
|
4.6
|
2.7
|
1.0
|
CA
|
A:GLU343
|
4.7
|
2.7
|
1.0
|
N
|
A:ALA342
|
4.8
|
2.6
|
1.0
|
CA
|
A:LEU369
|
4.8
|
2.7
|
1.0
|
C
|
A:LEU369
|
4.9
|
2.7
|
1.0
|
NH1
|
A:ARG345
|
4.9
|
2.6
|
1.0
|
|
Chlorine binding site 5 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 5 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl496
b:49.7
occ:1.00
|
CZ
|
A:TYR358
|
4.3
|
2.7
|
1.0
|
CE2
|
A:TYR358
|
4.4
|
2.7
|
1.0
|
CE1
|
A:TYR358
|
4.5
|
2.6
|
1.0
|
OH
|
A:TYR358
|
4.6
|
2.8
|
1.0
|
CB
|
A:GLN357
|
4.6
|
2.7
|
1.0
|
CD2
|
A:TYR358
|
4.7
|
2.7
|
1.0
|
CD1
|
A:TYR358
|
4.8
|
2.7
|
1.0
|
O
|
A:GLN357
|
4.9
|
2.7
|
1.0
|
CG
|
A:TYR358
|
4.9
|
2.7
|
1.0
|
C
|
A:GLN357
|
5.0
|
2.7
|
1.0
|
|
Chlorine binding site 6 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 6 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl492
b:58.3
occ:1.00
|
O
|
B:HOH522
|
3.1
|
2.0
|
1.0
|
N
|
B:VAL54
|
3.4
|
2.7
|
1.0
|
CG2
|
B:VAL54
|
3.5
|
2.7
|
1.0
|
CA
|
B:LYS53
|
3.6
|
2.6
|
1.0
|
CA
|
B:GLY77
|
3.8
|
2.6
|
1.0
|
C
|
B:LYS53
|
4.0
|
2.7
|
1.0
|
O
|
B:SER52
|
4.1
|
2.8
|
1.0
|
CB
|
B:VAL54
|
4.3
|
2.7
|
1.0
|
CG
|
B:LYS53
|
4.3
|
2.7
|
1.0
|
CA
|
B:VAL54
|
4.4
|
2.6
|
1.0
|
N
|
B:LYS53
|
4.4
|
2.6
|
1.0
|
CB
|
B:LYS53
|
4.5
|
2.6
|
1.0
|
C
|
B:SER52
|
4.6
|
2.6
|
1.0
|
N
|
B:GLY77
|
4.7
|
2.6
|
1.0
|
OE1
|
B:GLU22
|
4.9
|
12.3
|
1.0
|
C
|
B:GLY77
|
5.0
|
2.6
|
1.0
|
|
Chlorine binding site 7 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 7 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 7 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl493
b:60.8
occ:1.00
|
N
|
B:HIS23
|
3.3
|
11.7
|
1.0
|
N
|
B:LEU79
|
3.4
|
2.7
|
1.0
|
O
|
B:HIS23
|
3.7
|
12.6
|
1.0
|
N
|
B:GLU22
|
3.8
|
10.3
|
1.0
|
CG
|
B:GLN26
|
3.8
|
16.9
|
1.0
|
CB
|
B:LEU79
|
3.9
|
2.7
|
1.0
|
CB
|
B:PRO21
|
3.9
|
9.4
|
1.0
|
CG
|
B:LEU79
|
3.9
|
2.7
|
1.0
|
CB
|
B:HIS23
|
3.9
|
12.1
|
1.0
|
CA
|
B:ASN78
|
4.0
|
2.7
|
1.0
|
O
|
B:GLY77
|
4.0
|
2.6
|
1.0
|
OD1
|
B:ASN78
|
4.0
|
2.7
|
1.0
|
CA
|
B:HIS23
|
4.0
|
12.2
|
1.0
|
CB
|
B:GLU22
|
4.0
|
10.9
|
1.0
|
CD2
|
B:HIS23
|
4.1
|
11.9
|
1.0
|
CB
|
B:GLN26
|
4.1
|
16.5
|
1.0
|
C
|
B:ASN78
|
4.2
|
2.7
|
1.0
|
CA
|
B:GLU22
|
4.2
|
10.9
|
1.0
|
C
|
B:GLU22
|
4.2
|
11.2
|
1.0
|
CD1
|
B:LEU79
|
4.2
|
2.6
|
1.0
|
CA
|
B:LEU79
|
4.2
|
2.7
|
1.0
|
C
|
B:HIS23
|
4.3
|
12.6
|
1.0
|
CG
|
B:HIS23
|
4.4
|
12.0
|
1.0
|
CG
|
B:ASN78
|
4.4
|
2.7
|
1.0
|
C
|
B:PRO21
|
4.5
|
9.8
|
1.0
|
CA
|
B:PRO21
|
4.7
|
9.5
|
1.0
|
CB
|
B:ASN78
|
4.8
|
2.7
|
1.0
|
C
|
B:GLY77
|
4.8
|
2.6
|
1.0
|
CG
|
B:PRO21
|
4.8
|
9.2
|
1.0
|
N
|
B:ASN78
|
4.9
|
2.7
|
1.0
|
CD
|
B:GLN26
|
4.9
|
17.5
|
1.0
|
|
Chlorine binding site 8 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 8 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 8 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl494
b:44.8
occ:1.00
|
OG1
|
B:THR328
|
3.5
|
2.7
|
1.0
|
O
|
B:VAL326
|
4.0
|
2.6
|
1.0
|
N
|
B:THR328
|
4.5
|
2.7
|
1.0
|
CE1
|
C:TYR141
|
4.6
|
2.7
|
1.0
|
CA
|
B:PHE327
|
4.7
|
2.6
|
1.0
|
CB
|
B:THR328
|
4.8
|
2.6
|
1.0
|
C
|
B:PHE327
|
4.8
|
2.7
|
1.0
|
C
|
B:VAL326
|
4.8
|
2.6
|
1.0
|
CD1
|
C:TYR141
|
4.9
|
2.6
|
1.0
|
|
Chlorine binding site 9 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 9 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 9 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl495
b:52.9
occ:1.00
|
OE1
|
B:GLU333
|
3.9
|
2.8
|
1.0
|
CD
|
B:GLU333
|
4.2
|
2.8
|
1.0
|
OE2
|
B:GLU333
|
4.4
|
2.9
|
1.0
|
NE2
|
B:HIS447
|
4.6
|
2.6
|
1.0
|
CB
|
B:SER331
|
4.7
|
2.7
|
1.0
|
CE1
|
B:PHE353
|
4.7
|
2.6
|
1.0
|
O
|
B:HIS447
|
4.9
|
2.7
|
1.0
|
|
Chlorine binding site 10 out
of 67 in 3kzw
Go back to
Chlorine Binding Sites List in 3kzw
Chlorine binding site 10 out
of 67 in the Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 10 of Crystal Structure of Cytosol Aminopeptidase From Staphylococcus Aureus Col within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Cl496
b:25.6
occ:1.00
|
NE
|
B:ARG345
|
3.0
|
2.6
|
1.0
|
N
|
B:ARG345
|
3.1
|
2.6
|
1.0
|
N
|
B:GLY344
|
3.3
|
2.7
|
1.0
|
C
|
B:ALA342
|
3.5
|
2.7
|
1.0
|
CA
|
B:ALA342
|
3.5
|
2.6
|
1.0
|
NH2
|
B:ARG345
|
3.6
|
2.5
|
1.0
|
CD2
|
B:LEU369
|
3.6
|
2.7
|
1.0
|
CA
|
B:GLY344
|
3.7
|
2.7
|
1.0
|
CZ
|
B:ARG345
|
3.7
|
2.6
|
1.0
|
CG
|
B:ARG345
|
3.8
|
2.6
|
1.0
|
O
|
B:ALA342
|
3.8
|
2.7
|
1.0
|
O
|
B:HOH679
|
3.8
|
16.7
|
1.0
|
N
|
B:GLU343
|
3.8
|
2.7
|
1.0
|
C
|
B:GLY344
|
3.9
|
2.7
|
1.0
|
CB
|
B:ARG345
|
3.9
|
2.6
|
1.0
|
CD
|
B:ARG345
|
3.9
|
2.6
|
1.0
|
CB
|
B:ALA342
|
4.1
|
2.5
|
1.0
|
CA
|
B:ARG345
|
4.1
|
2.6
|
1.0
|
C
|
B:GLU343
|
4.3
|
2.8
|
1.0
|
CG
|
B:LEU369
|
4.4
|
2.8
|
1.0
|
CD1
|
B:LEU369
|
4.4
|
2.7
|
1.0
|
O
|
B:ASP341
|
4.6
|
2.7
|
1.0
|
O
|
B:LEU369
|
4.6
|
2.9
|
1.0
|
CB
|
B:LEU369
|
4.7
|
2.7
|
1.0
|
CA
|
B:GLU343
|
4.7
|
2.7
|
1.0
|
N
|
B:ALA342
|
4.8
|
2.6
|
1.0
|
CA
|
B:LEU369
|
4.8
|
2.7
|
1.0
|
C
|
B:LEU369
|
4.9
|
2.7
|
1.0
|
|
Reference:
J.Hattne,
I.Dubrovska,
A.Halavaty,
G.Minasov,
P.Scott,
L.Shuvalova,
J.Winsor,
Z.Otwinowski,
Center For Structural Genomics Of Infectiousdiseases (Csgid).
N/A N/A.
Page generated: Sat Jul 20 22:56:55 2024
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