Zinc in PDB 1f1m: Crystal Structure of Outer Surface Protein C (Ospc)
Protein crystallography data
The structure of Crystal Structure of Outer Surface Protein C (Ospc), PDB code: 1f1m
was solved by
D.Kumaran,
S.Eswaramoorthy,
J.J.Dunn,
S.Swaminathan,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
50.00 /
1.80
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
66.323,
46.252,
111.784,
90.00,
99.08,
90.00
|
R / Rfree (%)
|
20.1 /
23.5
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Crystal Structure of Outer Surface Protein C (Ospc)
(pdb code 1f1m). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 6 binding sites of Zinc where determined in the
Crystal Structure of Outer Surface Protein C (Ospc), PDB code: 1f1m:
Jump to Zinc binding site number:
1;
2;
3;
4;
5;
6;
Zinc binding site 1 out
of 6 in 1f1m
Go back to
Zinc Binding Sites List in 1f1m
Zinc binding site 1 out
of 6 in the Crystal Structure of Outer Surface Protein C (Ospc)
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Crystal Structure of Outer Surface Protein C (Ospc) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn801
b:19.4
occ:1.00
|
O
|
A:HOH959
|
1.8
|
15.3
|
1.0
|
O
|
A:HOH960
|
1.9
|
18.9
|
1.0
|
NE2
|
A:HIS92
|
2.2
|
14.8
|
1.0
|
O
|
A:HOH896
|
2.3
|
23.6
|
1.0
|
O
|
A:HOH809
|
2.3
|
21.5
|
1.0
|
CD2
|
A:HIS92
|
3.0
|
17.4
|
1.0
|
CE1
|
A:HIS92
|
3.4
|
17.9
|
1.0
|
OE2
|
A:GLU89
|
3.9
|
37.6
|
1.0
|
O
|
A:ALA90
|
4.1
|
22.7
|
1.0
|
O
|
B:HOH965
|
4.2
|
40.4
|
1.0
|
CG
|
A:HIS92
|
4.2
|
15.2
|
1.0
|
ND1
|
A:HIS92
|
4.4
|
15.1
|
1.0
|
O
|
A:HOH922
|
4.4
|
25.4
|
1.0
|
O
|
A:HOH850
|
4.4
|
20.7
|
1.0
|
CD
|
A:GLU89
|
4.9
|
35.2
|
1.0
|
CG
|
B:GLU148
|
4.9
|
20.9
|
1.0
|
|
Zinc binding site 2 out
of 6 in 1f1m
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Zinc Binding Sites List in 1f1m
Zinc binding site 2 out
of 6 in the Crystal Structure of Outer Surface Protein C (Ospc)
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Crystal Structure of Outer Surface Protein C (Ospc) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn802
b:27.5
occ:1.00
|
NE2
|
B:HIS142
|
2.1
|
20.6
|
1.0
|
O
|
B:HOH968
|
2.3
|
40.6
|
1.0
|
O
|
B:HOH983
|
2.4
|
26.6
|
1.0
|
CD2
|
B:HIS142
|
3.1
|
20.6
|
1.0
|
CE1
|
B:HIS142
|
3.1
|
21.2
|
1.0
|
ND1
|
B:HIS142
|
4.2
|
20.4
|
1.0
|
CG
|
B:HIS142
|
4.2
|
21.3
|
1.0
|
O
|
B:HOH812
|
4.3
|
19.5
|
1.0
|
CB
|
A:SER82
|
4.6
|
34.4
|
1.0
|
OG1
|
B:THR143
|
4.6
|
25.4
|
1.0
|
O
|
B:GLY140
|
4.7
|
22.0
|
1.0
|
OG
|
A:SER82
|
4.8
|
39.1
|
1.0
|
|
Zinc binding site 3 out
of 6 in 1f1m
Go back to
Zinc Binding Sites List in 1f1m
Zinc binding site 3 out
of 6 in the Crystal Structure of Outer Surface Protein C (Ospc)
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 3 of Crystal Structure of Outer Surface Protein C (Ospc) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn803
b:35.5
occ:1.00
|
NE2
|
B:HIS92
|
2.2
|
18.1
|
1.0
|
O
|
B:HOH984
|
2.2
|
31.8
|
1.0
|
O
|
B:HOH967
|
2.3
|
29.1
|
1.0
|
O
|
B:HOH912
|
2.3
|
23.4
|
1.0
|
O
|
B:HOH913
|
2.4
|
35.3
|
1.0
|
CD2
|
B:HIS92
|
3.0
|
16.9
|
1.0
|
CE1
|
B:HIS92
|
3.3
|
17.2
|
1.0
|
O
|
B:ALA90
|
3.9
|
17.4
|
1.0
|
CG
|
B:HIS92
|
4.2
|
17.5
|
1.0
|
ND1
|
B:HIS92
|
4.3
|
16.9
|
1.0
|
O
|
B:HOH815
|
4.4
|
19.3
|
1.0
|
O
|
B:HOH948
|
4.4
|
33.1
|
1.0
|
O
|
B:HOH975
|
4.5
|
49.5
|
1.0
|
OE1
|
B:GLU89
|
4.7
|
36.4
|
1.0
|
|
Zinc binding site 4 out
of 6 in 1f1m
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Zinc Binding Sites List in 1f1m
Zinc binding site 4 out
of 6 in the Crystal Structure of Outer Surface Protein C (Ospc)
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 4 of Crystal Structure of Outer Surface Protein C (Ospc) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Zn804
b:33.3
occ:1.00
|
NE2
|
C:HIS92
|
2.1
|
12.8
|
1.0
|
O
|
C:HOH859
|
2.3
|
36.2
|
1.0
|
O
|
C:HOH822
|
2.3
|
43.7
|
1.0
|
CD2
|
C:HIS92
|
2.9
|
12.6
|
1.0
|
CE1
|
C:HIS92
|
3.3
|
15.2
|
1.0
|
OE2
|
C:GLU89
|
3.9
|
36.0
|
1.0
|
CG
|
C:HIS92
|
4.1
|
13.3
|
1.0
|
O
|
C:ALA90
|
4.2
|
19.9
|
1.0
|
ND1
|
C:HIS92
|
4.3
|
13.2
|
1.0
|
O
|
D:HOH861
|
4.6
|
23.2
|
1.0
|
O
|
C:HOH843
|
4.7
|
40.2
|
1.0
|
CG
|
D:GLU148
|
4.8
|
20.3
|
1.0
|
O
|
C:HOH915
|
4.9
|
36.7
|
1.0
|
|
Zinc binding site 5 out
of 6 in 1f1m
Go back to
Zinc Binding Sites List in 1f1m
Zinc binding site 5 out
of 6 in the Crystal Structure of Outer Surface Protein C (Ospc)
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 5 of Crystal Structure of Outer Surface Protein C (Ospc) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn805
b:29.9
occ:1.00
|
NE2
|
D:HIS142
|
2.1
|
15.4
|
1.0
|
O
|
D:HOH957
|
2.3
|
34.4
|
1.0
|
CE1
|
D:HIS142
|
2.9
|
17.0
|
1.0
|
CD2
|
D:HIS142
|
3.2
|
18.6
|
1.0
|
O
|
C:HOH871
|
3.3
|
34.2
|
1.0
|
O
|
D:HOH816
|
3.8
|
12.3
|
1.0
|
ND1
|
D:HIS142
|
4.1
|
16.8
|
1.0
|
CG
|
D:HIS142
|
4.2
|
17.6
|
1.0
|
O
|
D:GLY140
|
4.5
|
13.3
|
1.0
|
OG1
|
D:THR143
|
4.6
|
16.6
|
1.0
|
OG
|
C:SER82
|
4.7
|
35.8
|
1.0
|
CB
|
C:SER82
|
4.9
|
25.1
|
1.0
|
|
Zinc binding site 6 out
of 6 in 1f1m
Go back to
Zinc Binding Sites List in 1f1m
Zinc binding site 6 out
of 6 in the Crystal Structure of Outer Surface Protein C (Ospc)
 Mono view
 Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 6 of Crystal Structure of Outer Surface Protein C (Ospc) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Zn806
b:36.7
occ:1.00
|
O
|
D:HOH933
|
2.3
|
34.0
|
1.0
|
NE2
|
D:HIS92
|
2.3
|
15.3
|
1.0
|
O
|
D:HOH920
|
2.4
|
30.6
|
1.0
|
O
|
D:HOH926
|
2.4
|
21.6
|
1.0
|
CD2
|
D:HIS92
|
3.1
|
16.0
|
1.0
|
CE1
|
D:HIS92
|
3.5
|
17.4
|
1.0
|
OE2
|
D:GLU89
|
3.8
|
31.7
|
1.0
|
O
|
D:ALA90
|
4.0
|
14.1
|
1.0
|
O
|
C:HOH861
|
4.1
|
34.5
|
1.0
|
CG
|
D:HIS92
|
4.3
|
15.8
|
1.0
|
O
|
D:HOH818
|
4.4
|
20.2
|
1.0
|
ND1
|
D:HIS92
|
4.5
|
18.3
|
1.0
|
O
|
D:HOH871
|
4.8
|
36.9
|
1.0
|
|
Reference:
D.Kumaran,
S.Eswaramoorthy,
B.J.Luft,
S.Koide,
J.J.Dunn,
C.L.Lawson,
S.Swaminathan.
Crystal Structure of Outer Surface Protein C (Ospc) From the Lyme Disease Spirochete, Borrelia Burgdorferi. Embo J. V. 20 971 2001.
ISSN: ISSN 0261-4189
PubMed: 11230121
DOI: 10.1093/EMBOJ/20.5.971
Page generated: Sun Oct 13 00:38:07 2024
|