Calcium in PDB 1umn: Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Protein crystallography data
The structure of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis, PDB code: 1umn
was solved by
A.Kauko,
S.Haataja,
A.Pulliainen,
J.Finne,
A.C.Papageorgiou,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
18.08 /
1.95
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
104.735,
138.168,
142.707,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
18.5 /
22.4
|
Other elements in 1umn:
The structure of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis also contains other interesting chemical elements:
Calcium Binding Sites:
Pages:
>>> Page 1 <<<
Page 2, Binding sites: 11 -
16;
Binding sites:
The binding sites of Calcium atom in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
(pdb code 1umn). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 16 binding sites of Calcium where determined in the
Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis, PDB code: 1umn:
Jump to Calcium binding site number:
1;
2;
3;
4;
5;
6;
7;
8;
9;
10;
Calcium binding site 1 out
of 16 in 1umn
Go back to
Calcium Binding Sites List in 1umn
Calcium binding site 1 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca2173
b:35.2
occ:1.00
|
O
|
C:HOH2053
|
2.3
|
38.9
|
1.0
|
OD1
|
A:ASP63
|
2.5
|
25.0
|
1.0
|
O
|
A:HOH2043
|
2.5
|
23.9
|
1.0
|
O
|
C:HOH2052
|
2.5
|
28.8
|
1.0
|
O
|
A:HOH2044
|
2.6
|
45.1
|
1.0
|
CG
|
A:ASP63
|
3.4
|
24.3
|
1.0
|
OD2
|
A:ASP63
|
3.6
|
24.9
|
1.0
|
O
|
A:HOH2056
|
4.2
|
38.1
|
1.0
|
OD2
|
C:ASP74
|
4.5
|
20.6
|
1.0
|
O
|
A:HOH2022
|
4.6
|
36.9
|
1.0
|
OD1
|
C:ASP74
|
4.7
|
20.4
|
1.0
|
CB
|
A:ASP63
|
4.8
|
21.6
|
1.0
|
O
|
A:ASP63
|
4.8
|
18.6
|
1.0
|
|
Calcium binding site 2 out
of 16 in 1umn
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Calcium Binding Sites List in 1umn
Calcium binding site 2 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca2173
b:31.5
occ:1.00
|
O
|
D:HOH2074
|
2.3
|
35.9
|
1.0
|
O
|
D:HOH2064
|
2.4
|
40.8
|
1.0
|
O
|
B:HOH2045
|
2.4
|
22.8
|
1.0
|
OD1
|
B:ASP63
|
2.5
|
21.9
|
1.0
|
O
|
B:HOH2043
|
2.5
|
42.9
|
1.0
|
O
|
D:HOH2073
|
2.7
|
24.4
|
1.0
|
CG
|
B:ASP63
|
3.5
|
20.9
|
1.0
|
OD2
|
B:ASP63
|
3.8
|
23.4
|
1.0
|
O
|
B:HOH2057
|
3.9
|
33.7
|
1.0
|
OD2
|
D:ASP74
|
4.5
|
17.6
|
1.0
|
OD1
|
D:ASP74
|
4.6
|
16.9
|
1.0
|
O
|
D:HOH2075
|
4.7
|
24.4
|
1.0
|
O
|
B:HOH2021
|
4.7
|
28.8
|
1.0
|
CB
|
B:ASP63
|
4.8
|
19.6
|
1.0
|
O
|
B:ASP63
|
4.9
|
17.6
|
1.0
|
|
Calcium binding site 3 out
of 16 in 1umn
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Calcium Binding Sites List in 1umn
Calcium binding site 3 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Ca2173
b:34.3
occ:1.00
|
O
|
A:HOH2024
|
2.2
|
41.0
|
1.0
|
O
|
A:HOH2061
|
2.3
|
39.1
|
1.0
|
O
|
C:HOH2038
|
2.4
|
45.1
|
1.0
|
OD1
|
C:ASP63
|
2.4
|
24.9
|
1.0
|
O
|
A:HOH2063
|
2.4
|
24.2
|
1.0
|
O
|
C:HOH2037
|
2.6
|
21.9
|
1.0
|
CG
|
C:ASP63
|
3.4
|
23.9
|
1.0
|
OD2
|
C:ASP63
|
3.8
|
25.2
|
1.0
|
O
|
C:HOH2046
|
4.1
|
23.9
|
1.0
|
OD2
|
A:ASP74
|
4.4
|
22.5
|
1.0
|
O
|
C:HOH2018
|
4.5
|
31.9
|
1.0
|
OD1
|
A:ASP74
|
4.6
|
22.5
|
1.0
|
O
|
A:HOH2060
|
4.7
|
26.6
|
1.0
|
CB
|
C:ASP63
|
4.8
|
22.4
|
1.0
|
CG
|
A:ASP74
|
4.9
|
22.2
|
1.0
|
O
|
C:ASP63
|
4.9
|
20.8
|
1.0
|
|
Calcium binding site 4 out
of 16 in 1umn
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Calcium Binding Sites List in 1umn
Calcium binding site 4 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ca1175
b:27.3
occ:1.00
|
O
|
D:HOH2114
|
2.4
|
24.1
|
1.0
|
O
|
D:HOH2116
|
2.5
|
27.2
|
1.0
|
O
|
D:HOH2032
|
2.5
|
40.4
|
1.0
|
O
|
G:HOH2129
|
2.5
|
25.2
|
1.0
|
O
|
D:HOH2112
|
2.5
|
39.5
|
1.0
|
O
|
D:HOH2014
|
4.5
|
25.9
|
1.0
|
O
|
D:ASN108
|
4.5
|
21.8
|
1.0
|
O
|
D:HOH2031
|
4.7
|
31.8
|
1.0
|
O
|
D:TYR107
|
4.7
|
19.9
|
1.0
|
CA
|
D:ASN108
|
4.7
|
21.3
|
1.0
|
C
|
D:ASN108
|
4.8
|
20.9
|
1.0
|
O
|
G:GLY167
|
4.8
|
20.5
|
1.0
|
O
|
D:ARG51
|
4.9
|
17.4
|
1.0
|
O
|
D:VAL109
|
4.9
|
18.8
|
1.0
|
|
Calcium binding site 5 out
of 16 in 1umn
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Calcium Binding Sites List in 1umn
Calcium binding site 5 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 5 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ca2173
b:33.6
occ:1.00
|
O
|
B:HOH2064
|
2.5
|
30.0
|
1.0
|
OD1
|
D:ASP63
|
2.5
|
23.3
|
1.0
|
O
|
B:HOH2065
|
2.5
|
24.2
|
1.0
|
O
|
D:HOH2049
|
2.5
|
31.9
|
1.0
|
O
|
D:HOH2051
|
2.6
|
18.7
|
1.0
|
O
|
B:HOH2024
|
2.6
|
39.5
|
1.0
|
CG
|
D:ASP63
|
3.4
|
21.8
|
1.0
|
OD2
|
D:ASP63
|
3.5
|
24.0
|
1.0
|
O
|
D:HOH2065
|
4.1
|
25.7
|
1.0
|
OD2
|
B:ASP74
|
4.5
|
19.1
|
1.0
|
OD1
|
B:ASP74
|
4.6
|
19.1
|
1.0
|
CB
|
D:ASP63
|
4.8
|
20.2
|
1.0
|
O
|
D:HOH2022
|
4.8
|
36.2
|
1.0
|
O
|
D:ASP63
|
4.9
|
16.5
|
1.0
|
O
|
B:HOH2056
|
4.9
|
24.5
|
1.0
|
|
Calcium binding site 6 out
of 16 in 1umn
Go back to
Calcium Binding Sites List in 1umn
Calcium binding site 6 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 6 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
E:Ca2173
b:42.5
occ:1.00
|
O
|
E:HOH2020
|
2.3
|
47.6
|
1.0
|
OD1
|
E:ASP63
|
2.4
|
25.5
|
1.0
|
O
|
G:HOH2058
|
2.4
|
33.2
|
1.0
|
O
|
E:HOH2046
|
2.5
|
28.2
|
1.0
|
O
|
G:HOH2056
|
2.7
|
32.8
|
1.0
|
CG
|
E:ASP63
|
3.3
|
24.7
|
1.0
|
OD2
|
E:ASP63
|
3.5
|
26.5
|
1.0
|
O
|
E:HOH2057
|
3.8
|
31.0
|
1.0
|
O
|
E:HOH2022
|
4.3
|
32.7
|
1.0
|
OD2
|
G:ASP74
|
4.5
|
21.0
|
1.0
|
OD1
|
G:ASP74
|
4.6
|
21.0
|
1.0
|
CB
|
E:ASP63
|
4.7
|
23.1
|
1.0
|
O
|
G:HOH2055
|
4.7
|
30.1
|
1.0
|
O
|
E:ASP63
|
4.8
|
20.4
|
1.0
|
|
Calcium binding site 7 out
of 16 in 1umn
Go back to
Calcium Binding Sites List in 1umn
Calcium binding site 7 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 7 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
F:Ca2173
b:35.1
occ:1.00
|
O
|
F:HOH2048
|
2.4
|
22.4
|
1.0
|
O
|
H:HOH2044
|
2.5
|
34.2
|
1.0
|
OD1
|
F:ASP63
|
2.5
|
23.6
|
1.0
|
O
|
H:HOH2045
|
2.5
|
33.1
|
1.0
|
O
|
F:HOH2027
|
2.8
|
53.1
|
1.0
|
CG
|
F:ASP63
|
3.5
|
22.3
|
1.0
|
OD2
|
F:ASP63
|
3.7
|
24.7
|
1.0
|
O
|
F:HOH2054
|
3.9
|
29.6
|
1.0
|
OD2
|
H:ASP74
|
4.5
|
21.8
|
1.0
|
OD1
|
H:ASP74
|
4.6
|
21.8
|
1.0
|
O
|
F:HOH2026
|
4.8
|
35.4
|
1.0
|
CB
|
F:ASP63
|
4.8
|
20.7
|
1.0
|
O
|
F:ASP63
|
4.9
|
18.0
|
1.0
|
O
|
H:HOH2046
|
4.9
|
23.9
|
1.0
|
CG
|
H:ASP74
|
5.0
|
21.9
|
1.0
|
|
Calcium binding site 8 out
of 16 in 1umn
Go back to
Calcium Binding Sites List in 1umn
Calcium binding site 8 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 8 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Ca1174
b:28.9
occ:1.00
|
O
|
G:HOH2097
|
2.4
|
28.9
|
1.0
|
O
|
G:HOH2086
|
2.5
|
25.8
|
1.0
|
O
|
G:ASN108
|
2.7
|
27.4
|
1.0
|
C
|
G:ASN108
|
3.9
|
27.0
|
1.0
|
OE1
|
G:GLU113
|
4.4
|
23.8
|
1.0
|
CB
|
G:ASN108
|
4.5
|
27.4
|
1.0
|
CA
|
G:VAL109
|
4.7
|
26.4
|
1.0
|
OE2
|
G:GLU113
|
4.7
|
24.5
|
1.0
|
N
|
G:VAL109
|
4.8
|
26.8
|
1.0
|
CA
|
G:ASN108
|
4.9
|
26.9
|
1.0
|
|
Calcium binding site 9 out
of 16 in 1umn
Go back to
Calcium Binding Sites List in 1umn
Calcium binding site 9 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 9 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
G:Ca2173
b:34.8
occ:1.00
|
O
|
E:HOH2059
|
2.4
|
33.3
|
1.0
|
OD1
|
G:ASP63
|
2.4
|
26.6
|
1.0
|
O
|
G:HOH2042
|
2.5
|
30.2
|
1.0
|
O
|
E:HOH2025
|
2.5
|
41.9
|
1.0
|
O
|
G:HOH2044
|
2.6
|
25.4
|
1.0
|
O
|
E:HOH2060
|
2.6
|
33.5
|
1.0
|
CG
|
G:ASP63
|
3.4
|
25.0
|
1.0
|
OD2
|
G:ASP63
|
3.6
|
26.4
|
1.0
|
O
|
G:HOH2053
|
3.8
|
37.1
|
1.0
|
O
|
E:HOH2062
|
4.2
|
38.5
|
1.0
|
OD2
|
E:ASP74
|
4.4
|
23.5
|
1.0
|
O
|
G:HOH2022
|
4.6
|
35.5
|
1.0
|
OD1
|
E:ASP74
|
4.6
|
23.0
|
1.0
|
O
|
E:HOH2061
|
4.7
|
30.0
|
1.0
|
CB
|
G:ASP63
|
4.7
|
23.4
|
1.0
|
O
|
G:ASP63
|
4.8
|
20.6
|
1.0
|
CG
|
E:ASP74
|
5.0
|
23.2
|
1.0
|
|
Calcium binding site 10 out
of 16 in 1umn
Go back to
Calcium Binding Sites List in 1umn
Calcium binding site 10 out
of 16 in the Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 10 of Crystal Structure of Dps-Like Peroxide Resistance Protein (Dpr) From Streptococcus Suis within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
H:Ca2173
b:36.2
occ:1.00
|
O
|
F:HOH2059
|
2.4
|
25.5
|
1.0
|
O
|
H:HOH2029
|
2.5
|
39.5
|
1.0
|
O
|
H:HOH2028
|
2.5
|
22.7
|
1.0
|
OD1
|
H:ASP63
|
2.6
|
22.4
|
1.0
|
O
|
F:HOH2055
|
2.6
|
36.5
|
1.0
|
CG
|
H:ASP63
|
3.5
|
21.8
|
1.0
|
OD2
|
H:ASP63
|
3.7
|
24.2
|
1.0
|
O
|
H:HOH2039
|
4.2
|
36.2
|
1.0
|
OD2
|
F:ASP74
|
4.5
|
19.8
|
1.0
|
O
|
H:HOH2013
|
4.5
|
31.9
|
1.0
|
OD1
|
F:ASP74
|
4.6
|
17.2
|
1.0
|
O
|
F:HOH2056
|
4.8
|
20.6
|
1.0
|
CB
|
H:ASP63
|
4.9
|
20.4
|
1.0
|
O
|
H:ASP63
|
4.9
|
17.4
|
1.0
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Reference:
A.Kauko,
S.Haataja,
A.T.Pulliainen,
J.Finne,
A.C.Papageorgiou.
Crystal Structure of Streptococcus Suis Dps-Like Peroxide Resistance Protein Dpr: Implications For Iron Incorporation. J. Mol. Biol. V. 338 547 2004.
ISSN: ISSN 0022-2836
PubMed: 15081812
DOI: 10.1016/J.JMB.2004.03.009
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