Zinc in PDB 6jf6: Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii
Enzymatic activity of Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii
All present enzymatic activity of Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii:
3.5.1.88;
Protein crystallography data
The structure of Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii, PDB code: 6jf6
was solved by
K.H.Jung,
T.H.Ho,
I.H.Lee,
L.W.Kang,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
49.99 /
2.35
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
71.370,
39.347,
110.353,
90.00,
89.98,
90.00
|
R / Rfree (%)
|
21 /
29.2
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii
(pdb code 6jf6). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 4 binding sites of Zinc where determined in the
Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii, PDB code: 6jf6:
Jump to Zinc binding site number:
1;
2;
3;
4;
Zinc binding site 1 out
of 4 in 6jf6
Go back to
Zinc Binding Sites List in 6jf6
Zinc binding site 1 out
of 4 in the Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn201
b:68.9
occ:1.00
|
SG
|
A:CYS103
|
1.5
|
53.3
|
1.0
|
NE2
|
A:HIS145
|
2.4
|
50.0
|
1.0
|
NE2
|
A:HIS149
|
2.6
|
58.2
|
1.0
|
O
|
A:HOH326
|
2.9
|
51.7
|
1.0
|
CD2
|
A:HIS145
|
3.1
|
43.2
|
1.0
|
CB
|
A:CYS103
|
3.1
|
51.4
|
1.0
|
CD2
|
A:HIS149
|
3.2
|
56.8
|
1.0
|
NE2
|
A:GLN55
|
3.4
|
49.5
|
1.0
|
OE1
|
A:GLN55
|
3.5
|
43.7
|
1.0
|
CA
|
A:CYS103
|
3.6
|
58.7
|
1.0
|
CE1
|
A:HIS145
|
3.6
|
47.2
|
1.0
|
OE2
|
A:GLU146
|
3.7
|
39.5
|
1.0
|
CD
|
A:GLN55
|
3.7
|
42.7
|
1.0
|
CE1
|
A:HIS149
|
3.8
|
59.1
|
1.0
|
O
|
A:HOH325
|
4.0
|
40.7
|
1.0
|
OE1
|
A:GLU146
|
4.1
|
38.5
|
1.0
|
CD
|
A:GLU146
|
4.3
|
36.3
|
1.0
|
CG
|
A:HIS145
|
4.4
|
41.8
|
1.0
|
N
|
A:LEU104
|
4.4
|
60.0
|
1.0
|
CG
|
A:HIS149
|
4.5
|
51.9
|
1.0
|
C
|
A:CYS103
|
4.5
|
61.3
|
1.0
|
ND1
|
A:HIS145
|
4.6
|
45.7
|
1.0
|
O
|
A:GLY102
|
4.6
|
68.8
|
1.0
|
N
|
A:CYS103
|
4.7
|
60.2
|
1.0
|
ND1
|
A:HIS149
|
4.7
|
50.4
|
1.0
|
O
|
A:HOH301
|
4.8
|
45.8
|
1.0
|
CG
|
A:GLN55
|
4.9
|
38.7
|
1.0
|
|
Zinc binding site 2 out
of 4 in 6jf6
Go back to
Zinc Binding Sites List in 6jf6
Zinc binding site 2 out
of 4 in the Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn201
b:43.4
occ:1.00
|
NE2
|
B:HIS145
|
2.1
|
53.2
|
1.0
|
NE2
|
B:HIS149
|
2.2
|
34.9
|
1.0
|
SG
|
B:CYS103
|
2.3
|
43.7
|
1.0
|
O
|
B:HOH302
|
2.4
|
25.3
|
1.0
|
CD2
|
B:HIS145
|
2.8
|
53.4
|
1.0
|
CD2
|
B:HIS149
|
2.9
|
36.6
|
1.0
|
O
|
B:HOH324
|
3.1
|
31.2
|
1.0
|
CE1
|
B:HIS145
|
3.2
|
53.3
|
1.0
|
CE1
|
B:HIS149
|
3.3
|
33.4
|
1.0
|
CB
|
B:CYS103
|
3.4
|
44.4
|
1.0
|
O
|
B:HOH314
|
3.5
|
23.9
|
1.0
|
NE2
|
B:GLN55
|
3.6
|
34.1
|
1.0
|
OE1
|
B:GLN55
|
3.7
|
37.0
|
1.0
|
CD
|
B:GLN55
|
3.8
|
38.8
|
1.0
|
CA
|
B:CYS103
|
4.0
|
43.1
|
1.0
|
CG
|
B:HIS145
|
4.0
|
47.3
|
1.0
|
O
|
B:HOH312
|
4.1
|
34.4
|
1.0
|
OE1
|
B:GLU146
|
4.2
|
34.1
|
1.0
|
CG
|
B:HIS149
|
4.2
|
34.9
|
1.0
|
ND1
|
B:HIS145
|
4.2
|
43.2
|
1.0
|
ND1
|
B:HIS149
|
4.3
|
36.0
|
1.0
|
OE2
|
B:GLU146
|
4.5
|
37.3
|
1.0
|
CD
|
B:GLU146
|
4.7
|
38.1
|
1.0
|
O
|
B:GLY102
|
4.8
|
39.6
|
1.0
|
CG
|
B:GLN55
|
4.9
|
35.7
|
1.0
|
C
|
B:CYS103
|
4.9
|
45.0
|
1.0
|
N
|
B:LEU104
|
5.0
|
40.3
|
1.0
|
|
Zinc binding site 3 out
of 4 in 6jf6
Go back to
Zinc Binding Sites List in 6jf6
Zinc binding site 3 out
of 4 in the Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn201
b:43.7
occ:1.00
|
NE2
|
C:HIS145
|
2.1
|
58.2
|
1.0
|
NE2
|
C:HIS149
|
2.2
|
43.4
|
1.0
|
O
|
E:HOH101
|
2.2
|
37.6
|
1.0
|
SG
|
C:CYS103
|
2.2
|
40.4
|
1.0
|
CD2
|
C:HIS145
|
2.9
|
55.0
|
1.0
|
O
|
C:HOH315
|
3.0
|
36.0
|
1.0
|
CE1
|
C:HIS149
|
3.1
|
46.8
|
1.0
|
CD2
|
C:HIS149
|
3.1
|
42.7
|
1.0
|
CB
|
C:CYS103
|
3.2
|
45.0
|
1.0
|
CE1
|
C:HIS145
|
3.3
|
56.3
|
1.0
|
NE2
|
C:GLN55
|
3.7
|
34.1
|
1.0
|
O
|
C:HOH311
|
3.8
|
28.4
|
1.0
|
N
|
E:MET1
|
3.9
|
71.1
|
1.0
|
CD
|
C:GLN55
|
3.9
|
39.1
|
1.0
|
OE1
|
C:GLN55
|
3.9
|
40.0
|
1.0
|
CA
|
C:CYS103
|
4.0
|
42.5
|
1.0
|
CG
|
C:HIS145
|
4.1
|
50.0
|
1.0
|
ND1
|
C:HIS149
|
4.2
|
48.5
|
1.0
|
CG
|
C:HIS149
|
4.3
|
45.9
|
1.0
|
ND1
|
C:HIS145
|
4.3
|
50.3
|
1.0
|
O
|
C:HOH302
|
4.3
|
46.1
|
1.0
|
OE1
|
C:GLU146
|
4.3
|
39.0
|
1.0
|
OE2
|
C:GLU146
|
4.5
|
38.2
|
1.0
|
CA
|
E:MET1
|
4.7
|
64.4
|
1.0
|
N
|
C:LEU104
|
4.8
|
44.9
|
1.0
|
CD
|
C:GLU146
|
4.8
|
40.0
|
1.0
|
CG
|
C:GLN55
|
4.8
|
37.8
|
1.0
|
C
|
C:CYS103
|
4.8
|
44.1
|
1.0
|
O
|
C:GLY102
|
4.8
|
38.6
|
1.0
|
|
Zinc binding site 4 out
of 4 in 6jf6
Go back to
Zinc Binding Sites List in 6jf6
Zinc binding site 4 out
of 4 in the Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn201
b:50.4
occ:1.00
|
NE2
|
D:HIS145
|
2.2
|
49.1
|
1.0
|
SG
|
D:CYS103
|
2.2
|
56.0
|
1.0
|
NE2
|
D:HIS149
|
2.2
|
36.0
|
1.0
|
O
|
D:HOH304
|
2.3
|
35.7
|
1.0
|
CD2
|
D:HIS145
|
3.1
|
42.5
|
1.0
|
CE1
|
D:HIS145
|
3.2
|
45.7
|
1.0
|
CD2
|
D:HIS149
|
3.2
|
34.6
|
1.0
|
CB
|
D:CYS103
|
3.2
|
56.8
|
1.0
|
CE1
|
D:HIS149
|
3.2
|
41.2
|
1.0
|
O
|
D:HOH318
|
3.3
|
44.2
|
1.0
|
O
|
D:HOH319
|
3.4
|
45.6
|
1.0
|
OE1
|
D:GLN55
|
3.7
|
48.0
|
1.0
|
CA
|
D:CYS103
|
3.8
|
56.9
|
1.0
|
NE2
|
D:GLN55
|
3.8
|
44.0
|
1.0
|
CD
|
D:GLN55
|
4.0
|
42.6
|
1.0
|
CG
|
D:HIS145
|
4.2
|
43.2
|
1.0
|
ND1
|
D:HIS145
|
4.3
|
48.1
|
1.0
|
N
|
D:LEU104
|
4.3
|
64.1
|
1.0
|
OE2
|
D:GLU146
|
4.3
|
36.0
|
1.0
|
ND1
|
D:HIS149
|
4.3
|
40.4
|
1.0
|
CG
|
D:HIS149
|
4.4
|
36.9
|
1.0
|
C
|
D:CYS103
|
4.5
|
61.7
|
1.0
|
OE1
|
D:GLU146
|
4.6
|
37.8
|
1.0
|
O
|
D:HOH314
|
4.7
|
50.1
|
1.0
|
O
|
D:GLY102
|
4.8
|
58.0
|
1.0
|
CD
|
D:GLU146
|
4.8
|
39.2
|
1.0
|
N
|
D:SER105
|
5.0
|
55.7
|
1.0
|
|
Reference:
K.H.Jung,
T.H.Ho,
I.H.Lee,
L.W.Kang.
Met-Ala-Ser Bound Crystal Structure of Class I Type B Peptide Deformylase From Acinetobacter Baumannii To Be Published.
Page generated: Tue Oct 29 01:07:12 2024
|