Calcium in PDB 8oia: Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose
Protein crystallography data
The structure of Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose, PDB code: 8oia
was solved by
M.Patrone,
B.J.Stockman,
M.Degano,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
43.98 /
2.30
|
Space group
|
C 1 2 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
116.995,
135.622,
94.075,
90,
104.69,
90
|
R / Rfree (%)
|
23.4 /
27
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose
(pdb code 8oia). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 4 binding sites of Calcium where determined in the
Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose, PDB code: 8oia:
Jump to Calcium binding site number:
1;
2;
3;
4;
Calcium binding site 1 out
of 4 in 8oia
Go back to
Calcium Binding Sites List in 8oia
Calcium binding site 1 out
of 4 in the Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca401
b:23.9
occ:1.00
|
O
|
A:THR142
|
2.4
|
21.1
|
1.0
|
OD1
|
A:ASP10
|
2.4
|
24.6
|
1.0
|
O2
|
A:RIB402
|
2.4
|
20.9
|
1.0
|
OD2
|
A:ASP263
|
2.5
|
18.3
|
1.0
|
OD1
|
A:ASP15
|
2.5
|
26.4
|
1.0
|
O3
|
A:RIB402
|
2.5
|
23.3
|
1.0
|
OD2
|
A:ASP15
|
2.5
|
23.1
|
1.0
|
O
|
A:HOH505
|
2.7
|
18.6
|
1.0
|
CG
|
A:ASP15
|
2.8
|
27.7
|
1.0
|
CG
|
A:ASP263
|
3.4
|
19.6
|
1.0
|
C2
|
A:RIB402
|
3.5
|
25.5
|
1.0
|
CG
|
A:ASP10
|
3.5
|
23.7
|
1.0
|
C3
|
A:RIB402
|
3.5
|
27.3
|
1.0
|
C
|
A:THR142
|
3.5
|
26.5
|
1.0
|
OD1
|
A:ASP263
|
3.7
|
21.4
|
1.0
|
OD2
|
A:ASP10
|
3.8
|
22.1
|
1.0
|
CA
|
A:GLY143
|
4.1
|
25.0
|
1.0
|
OG1
|
A:THR142
|
4.2
|
24.9
|
1.0
|
N
|
A:GLY143
|
4.2
|
25.4
|
1.0
|
CB
|
A:ASP15
|
4.3
|
29.6
|
1.0
|
CB
|
A:THR142
|
4.4
|
25.8
|
1.0
|
C4
|
A:RIB402
|
4.4
|
32.5
|
1.0
|
OD1
|
A:ASN184
|
4.5
|
30.5
|
1.0
|
N
|
A:ASP10
|
4.5
|
24.0
|
1.0
|
ND2
|
A:ASN184
|
4.5
|
24.8
|
1.0
|
O
|
A:ASP10
|
4.5
|
30.6
|
1.0
|
C1
|
A:RIB402
|
4.6
|
28.2
|
1.0
|
CA
|
A:THR142
|
4.6
|
28.1
|
1.0
|
O4
|
A:RIB402
|
4.7
|
28.9
|
1.0
|
N
|
A:ASP15
|
4.7
|
28.7
|
1.0
|
CB
|
A:ASP10
|
4.8
|
24.5
|
1.0
|
CB
|
A:ASP263
|
4.8
|
21.5
|
1.0
|
C
|
A:ASP10
|
4.8
|
29.2
|
1.0
|
CA
|
A:ASP15
|
4.9
|
28.9
|
1.0
|
CA
|
A:ASP10
|
4.9
|
26.0
|
1.0
|
CB
|
A:ASP14
|
4.9
|
29.4
|
1.0
|
CG
|
A:ASN184
|
5.0
|
27.8
|
1.0
|
O1
|
A:RIB402
|
5.0
|
30.5
|
1.0
|
|
Calcium binding site 2 out
of 4 in 8oia
Go back to
Calcium Binding Sites List in 8oia
Calcium binding site 2 out
of 4 in the Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca401
b:21.6
occ:1.00
|
O
|
B:HOH519
|
2.3
|
22.4
|
1.0
|
O3
|
B:RIB402
|
2.3
|
22.0
|
1.0
|
O
|
B:THR142
|
2.4
|
20.1
|
1.0
|
OD1
|
B:ASP15
|
2.4
|
21.9
|
1.0
|
OD1
|
B:ASP10
|
2.4
|
21.3
|
1.0
|
OD2
|
B:ASP263
|
2.4
|
21.5
|
1.0
|
OD2
|
B:ASP15
|
2.5
|
19.5
|
1.0
|
O2
|
B:RIB402
|
2.6
|
17.9
|
1.0
|
CG
|
B:ASP15
|
2.8
|
22.4
|
1.0
|
CG
|
B:ASP263
|
3.4
|
22.9
|
1.0
|
ND2
|
B:ASN39
|
3.4
|
20.8
|
1.0
|
CG
|
B:ASP10
|
3.5
|
22.3
|
1.0
|
C3
|
B:RIB402
|
3.5
|
22.9
|
1.0
|
C
|
B:THR142
|
3.5
|
20.1
|
1.0
|
C2
|
B:RIB402
|
3.6
|
21.7
|
1.0
|
OD1
|
B:ASP263
|
3.8
|
21.3
|
1.0
|
OD2
|
B:ASP10
|
3.9
|
23.6
|
1.0
|
OG1
|
B:THR142
|
4.2
|
21.5
|
1.0
|
CA
|
B:GLY143
|
4.2
|
22.4
|
1.0
|
N
|
B:GLY143
|
4.2
|
23.4
|
1.0
|
OD1
|
B:ASP14
|
4.2
|
23.5
|
1.0
|
CB
|
B:ASP15
|
4.2
|
22.9
|
1.0
|
CB
|
B:THR142
|
4.4
|
19.5
|
1.0
|
O
|
B:ASP10
|
4.4
|
26.6
|
1.0
|
C4
|
B:RIB402
|
4.5
|
27.3
|
1.0
|
CG
|
B:ASN39
|
4.5
|
22.7
|
1.0
|
OD1
|
B:ASN184
|
4.5
|
16.2
|
1.0
|
ND2
|
B:ASN184
|
4.5
|
16.0
|
1.0
|
OD2
|
B:ASP14
|
4.5
|
21.3
|
1.0
|
N
|
B:ASP10
|
4.5
|
20.5
|
1.0
|
O4
|
B:RIB402
|
4.6
|
22.1
|
1.0
|
CA
|
B:THR142
|
4.6
|
19.2
|
1.0
|
CG
|
B:ASP14
|
4.6
|
21.6
|
1.0
|
C1
|
B:RIB402
|
4.7
|
20.9
|
1.0
|
N
|
B:ASP15
|
4.7
|
25.9
|
1.0
|
C
|
B:ASP10
|
4.7
|
23.3
|
1.0
|
CB
|
B:ASP10
|
4.8
|
22.6
|
1.0
|
CB
|
B:ASP263
|
4.8
|
26.0
|
1.0
|
OD1
|
B:ASN39
|
4.9
|
21.7
|
1.0
|
CA
|
B:ASP15
|
4.9
|
24.6
|
1.0
|
CA
|
B:ASP10
|
4.9
|
21.7
|
1.0
|
CG
|
B:ASN184
|
5.0
|
18.1
|
1.0
|
O1
|
B:RIB402
|
5.0
|
23.4
|
1.0
|
|
Calcium binding site 3 out
of 4 in 8oia
Go back to
Calcium Binding Sites List in 8oia
Calcium binding site 3 out
of 4 in the Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
C:Ca401
b:22.1
occ:1.00
|
OD1
|
C:ASP10
|
2.4
|
24.2
|
1.0
|
O
|
C:THR142
|
2.4
|
23.4
|
1.0
|
O3
|
C:RIB402
|
2.4
|
24.7
|
1.0
|
OD1
|
C:ASP15
|
2.4
|
26.0
|
1.0
|
OD2
|
C:ASP263
|
2.4
|
27.9
|
1.0
|
O
|
C:HOH518
|
2.4
|
25.6
|
1.0
|
OD2
|
C:ASP15
|
2.5
|
26.2
|
1.0
|
O2
|
C:RIB402
|
2.5
|
20.5
|
1.0
|
CG
|
C:ASP15
|
2.7
|
30.9
|
1.0
|
CG
|
C:ASP263
|
3.4
|
25.8
|
1.0
|
CG
|
C:ASP10
|
3.4
|
21.9
|
1.0
|
ND2
|
C:ASN39
|
3.5
|
19.2
|
1.0
|
C
|
C:THR142
|
3.5
|
24.5
|
1.0
|
C3
|
C:RIB402
|
3.5
|
22.5
|
1.0
|
C2
|
C:RIB402
|
3.5
|
21.2
|
1.0
|
OD1
|
C:ASP263
|
3.8
|
24.7
|
1.0
|
OD2
|
C:ASP10
|
3.9
|
23.5
|
1.0
|
OG1
|
C:THR142
|
4.1
|
19.4
|
1.0
|
CA
|
C:GLY143
|
4.1
|
29.8
|
1.0
|
N
|
C:GLY143
|
4.2
|
30.3
|
1.0
|
CB
|
C:ASP15
|
4.2
|
27.0
|
1.0
|
OD1
|
C:ASP14
|
4.2
|
20.6
|
1.0
|
CB
|
C:THR142
|
4.4
|
21.3
|
1.0
|
O
|
C:ASP10
|
4.4
|
21.2
|
1.0
|
N
|
C:ASP10
|
4.5
|
17.9
|
1.0
|
ND2
|
C:ASN184
|
4.5
|
16.0
|
1.0
|
CG
|
C:ASN39
|
4.5
|
20.0
|
1.0
|
OD2
|
C:ASP14
|
4.5
|
24.2
|
1.0
|
OD1
|
C:ASN184
|
4.5
|
15.6
|
1.0
|
C4
|
C:RIB402
|
4.5
|
22.7
|
1.0
|
CA
|
C:THR142
|
4.6
|
21.3
|
1.0
|
C1
|
C:RIB402
|
4.7
|
19.3
|
1.0
|
CG
|
C:ASP14
|
4.7
|
21.4
|
1.0
|
N
|
C:ASP15
|
4.7
|
24.1
|
1.0
|
CB
|
C:ASP10
|
4.7
|
20.7
|
1.0
|
C
|
C:ASP10
|
4.7
|
21.2
|
1.0
|
O4
|
C:RIB402
|
4.7
|
20.1
|
1.0
|
CB
|
C:ASP263
|
4.8
|
28.9
|
1.0
|
OD1
|
C:ASN39
|
4.9
|
20.4
|
1.0
|
CA
|
C:ASP10
|
4.9
|
20.4
|
1.0
|
CA
|
C:ASP15
|
4.9
|
23.6
|
1.0
|
O1
|
C:RIB402
|
4.9
|
21.6
|
1.0
|
CG
|
C:ASN184
|
5.0
|
18.7
|
1.0
|
|
Calcium binding site 4 out
of 4 in 8oia
Go back to
Calcium Binding Sites List in 8oia
Calcium binding site 4 out
of 4 in the Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Trichomonas Vaginalis Riboside Hydrolase in Complex with D-Ribose within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
D:Ca401
b:23.1
occ:1.00
|
O
|
D:THR142
|
2.4
|
19.6
|
1.0
|
OD2
|
D:ASP263
|
2.4
|
21.8
|
1.0
|
O2
|
D:RIB402
|
2.4
|
23.2
|
1.0
|
O3
|
D:RIB402
|
2.4
|
23.1
|
1.0
|
OD1
|
D:ASP10
|
2.4
|
21.2
|
1.0
|
OD1
|
D:ASP15
|
2.4
|
24.8
|
1.0
|
OD2
|
D:ASP15
|
2.5
|
26.8
|
1.0
|
O
|
D:HOH509
|
2.6
|
18.2
|
1.0
|
CG
|
D:ASP15
|
2.7
|
28.6
|
1.0
|
CG
|
D:ASP263
|
3.4
|
22.5
|
1.0
|
C2
|
D:RIB402
|
3.4
|
26.9
|
1.0
|
C3
|
D:RIB402
|
3.5
|
26.1
|
1.0
|
CG
|
D:ASP10
|
3.5
|
23.3
|
1.0
|
C
|
D:THR142
|
3.5
|
25.1
|
1.0
|
OD1
|
D:ASP263
|
3.7
|
23.1
|
1.0
|
OD2
|
D:ASP10
|
3.8
|
20.6
|
1.0
|
OG1
|
D:THR142
|
4.1
|
22.1
|
1.0
|
CA
|
D:GLY143
|
4.2
|
26.5
|
1.0
|
N
|
D:GLY143
|
4.2
|
25.5
|
1.0
|
CB
|
D:ASP15
|
4.2
|
31.0
|
1.0
|
CB
|
D:THR142
|
4.4
|
25.0
|
1.0
|
C4
|
D:RIB402
|
4.4
|
28.6
|
1.0
|
OD1
|
D:ASN184
|
4.5
|
24.7
|
1.0
|
ND2
|
D:ASN184
|
4.5
|
23.1
|
1.0
|
N
|
D:ASP10
|
4.5
|
29.3
|
1.0
|
C1
|
D:RIB402
|
4.6
|
27.2
|
1.0
|
O
|
D:ASP10
|
4.6
|
30.6
|
1.0
|
CA
|
D:THR142
|
4.6
|
24.6
|
1.0
|
O4
|
D:RIB402
|
4.6
|
28.1
|
1.0
|
N
|
D:ASP15
|
4.7
|
30.2
|
1.0
|
CB
|
D:ASP263
|
4.7
|
21.5
|
1.0
|
CB
|
D:ASP10
|
4.8
|
24.6
|
1.0
|
C
|
D:ASP10
|
4.8
|
30.8
|
1.0
|
CA
|
D:ASP15
|
4.9
|
30.8
|
1.0
|
CB
|
D:ASP14
|
4.9
|
37.5
|
1.0
|
O1
|
D:RIB402
|
4.9
|
27.7
|
1.0
|
CA
|
D:ASP10
|
5.0
|
27.4
|
1.0
|
CG
|
D:ASN184
|
5.0
|
25.0
|
1.0
|
|
Reference:
M.Patrone,
G.S.Galasyn,
F.Kerin,
M.M.Nyitray,
D.W.Parkin,
B.J.Stockman,
M.Degano.
A Riboside Hydrolase That Salvages Both Nucleobases and Nicotinamide in the Auxotrophic Parasite Trichomonas Vaginalis. J.Biol.Chem. 05077 2023.
ISSN: ESSN 1083-351X
PubMed: 37482279
DOI: 10.1016/J.JBC.2023.105077
Page generated: Fri Jul 19 10:58:03 2024
|