Calcium in PDB 8gz0: Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus
Protein crystallography data
The structure of Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus, PDB code: 8gz0
was solved by
I.Yuvaraj,
K.Sekar,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
52.27 /
2.22
|
Space group
|
P 61 2 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
90.01,
90.01,
140.671,
90,
90,
120
|
R / Rfree (%)
|
17.4 /
21.3
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus
(pdb code 8gz0). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 4 binding sites of Calcium where determined in the
Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus, PDB code: 8gz0:
Jump to Calcium binding site number:
1;
2;
3;
4;
Calcium binding site 1 out
of 4 in 8gz0
Go back to
Calcium Binding Sites List in 8gz0
Calcium binding site 1 out
of 4 in the Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca201
b:17.8
occ:1.00
|
OD2
|
A:ASP40
|
2.2
|
17.7
|
1.0
|
OE2
|
A:GLU170
|
2.4
|
14.1
|
1.0
|
O
|
A:THR171
|
2.4
|
17.4
|
1.0
|
OG
|
B:SER25
|
2.4
|
16.3
|
1.0
|
OE1
|
A:GLU29
|
2.4
|
17.9
|
1.0
|
O
|
B:ILE24
|
2.4
|
15.4
|
1.0
|
OE2
|
A:GLU29
|
2.5
|
18.3
|
1.0
|
CD
|
A:GLU29
|
2.8
|
17.9
|
1.0
|
CG
|
A:ASP40
|
3.4
|
18.2
|
1.0
|
C
|
B:ILE24
|
3.4
|
16.0
|
1.0
|
CD
|
A:GLU170
|
3.5
|
15.0
|
1.0
|
CB
|
B:SER25
|
3.5
|
15.3
|
1.0
|
C
|
A:THR171
|
3.5
|
18.3
|
1.0
|
CA
|
B:SER25
|
3.6
|
14.9
|
1.0
|
N
|
B:SER25
|
3.9
|
15.3
|
1.0
|
CB
|
A:ASP40
|
4.0
|
17.8
|
1.0
|
O
|
A:HOH382
|
4.1
|
14.5
|
1.0
|
CG
|
A:GLU170
|
4.1
|
15.0
|
1.0
|
N
|
A:THR171
|
4.3
|
17.0
|
1.0
|
CG
|
A:GLU29
|
4.3
|
18.2
|
1.0
|
N
|
A:THR172
|
4.4
|
18.8
|
1.0
|
CA
|
A:THR172
|
4.4
|
19.5
|
1.0
|
OD1
|
A:ASP40
|
4.4
|
18.8
|
1.0
|
OE1
|
A:GLU170
|
4.4
|
15.1
|
1.0
|
CA
|
A:THR171
|
4.5
|
18.4
|
1.0
|
O
|
A:HOH343
|
4.7
|
11.6
|
1.0
|
N
|
B:ILE24
|
4.7
|
18.3
|
1.0
|
CA
|
B:ILE24
|
4.7
|
16.5
|
1.0
|
OG1
|
A:THR172
|
4.7
|
18.0
|
1.0
|
CG2
|
A:THR171
|
4.8
|
21.1
|
1.0
|
N
|
A:GLU29
|
5.0
|
16.0
|
1.0
|
|
Calcium binding site 2 out
of 4 in 8gz0
Go back to
Calcium Binding Sites List in 8gz0
Calcium binding site 2 out
of 4 in the Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca202
b:16.6
occ:1.00
|
OD1
|
A:ASP97
|
2.2
|
15.6
|
1.0
|
O
|
A:HOH348
|
2.3
|
15.6
|
1.0
|
O
|
A:GLY98
|
2.3
|
14.3
|
1.0
|
O
|
A:ALA103
|
2.3
|
16.5
|
1.0
|
O
|
A:GLY101
|
2.4
|
17.8
|
1.0
|
OD1
|
A:ASP95
|
2.4
|
14.2
|
1.0
|
OD2
|
A:ASP95
|
2.6
|
14.1
|
1.0
|
CG
|
A:ASP95
|
2.9
|
13.9
|
1.0
|
CG
|
A:ASP97
|
3.4
|
17.0
|
1.0
|
C
|
A:GLY98
|
3.4
|
14.5
|
1.0
|
C
|
A:ALA103
|
3.4
|
17.4
|
1.0
|
C
|
A:GLY101
|
3.5
|
18.6
|
1.0
|
N
|
A:ALA103
|
3.7
|
18.4
|
1.0
|
N
|
A:GLY98
|
3.8
|
14.8
|
1.0
|
CA
|
A:ALA103
|
4.0
|
18.1
|
1.0
|
C
|
A:ASP97
|
4.0
|
16.1
|
1.0
|
OD2
|
A:ASP97
|
4.0
|
17.2
|
1.0
|
CA
|
A:GLY98
|
4.1
|
14.2
|
1.0
|
C
|
A:PRO102
|
4.1
|
19.0
|
1.0
|
CB
|
A:ALA103
|
4.2
|
17.7
|
1.0
|
N
|
A:PRO102
|
4.3
|
19.1
|
1.0
|
CA
|
A:PRO102
|
4.3
|
19.2
|
1.0
|
N
|
A:GLY101
|
4.4
|
18.7
|
1.0
|
CB
|
A:ASP95
|
4.4
|
13.3
|
1.0
|
O
|
A:ASP97
|
4.4
|
16.3
|
1.0
|
CA
|
A:GLY101
|
4.4
|
19.3
|
1.0
|
CB
|
A:ASP97
|
4.5
|
17.2
|
1.0
|
N
|
A:PRO99
|
4.5
|
15.5
|
1.0
|
N
|
A:ASP97
|
4.5
|
16.9
|
1.0
|
CA
|
A:ASP97
|
4.6
|
16.5
|
1.0
|
N
|
A:SER104
|
4.6
|
16.9
|
1.0
|
O
|
A:PRO102
|
4.8
|
19.2
|
1.0
|
CA
|
A:PRO99
|
4.8
|
16.1
|
1.0
|
O
|
A:HOH373
|
5.0
|
17.5
|
1.0
|
CA
|
A:SER104
|
5.0
|
16.8
|
1.0
|
|
Calcium binding site 3 out
of 4 in 8gz0
Go back to
Calcium Binding Sites List in 8gz0
Calcium binding site 3 out
of 4 in the Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca201
b:14.3
occ:1.00
|
OD2
|
B:ASP40
|
2.3
|
13.8
|
1.0
|
OE2
|
B:GLU170
|
2.4
|
15.1
|
1.0
|
O
|
A:ILE24
|
2.4
|
13.1
|
1.0
|
O
|
B:THR171
|
2.4
|
16.8
|
1.0
|
OE1
|
B:GLU29
|
2.5
|
17.1
|
1.0
|
OG
|
A:SER25
|
2.5
|
12.8
|
1.0
|
OE2
|
B:GLU29
|
2.6
|
19.3
|
1.0
|
CD
|
B:GLU29
|
2.9
|
17.8
|
1.0
|
C
|
A:ILE24
|
3.4
|
13.2
|
1.0
|
CG
|
B:ASP40
|
3.4
|
15.1
|
1.0
|
CB
|
A:SER25
|
3.5
|
12.2
|
1.0
|
CD
|
B:GLU170
|
3.5
|
15.7
|
1.0
|
C
|
B:THR171
|
3.5
|
16.8
|
1.0
|
CA
|
A:SER25
|
3.6
|
12.3
|
1.0
|
N
|
A:SER25
|
3.9
|
12.1
|
1.0
|
CB
|
B:ASP40
|
4.0
|
15.1
|
1.0
|
O
|
B:HOH359
|
4.1
|
11.2
|
1.0
|
CG
|
B:GLU170
|
4.1
|
15.4
|
1.0
|
N
|
B:THR171
|
4.3
|
15.9
|
1.0
|
CA
|
B:THR172
|
4.3
|
17.0
|
1.0
|
N
|
B:THR172
|
4.4
|
17.0
|
1.0
|
CG
|
B:GLU29
|
4.4
|
17.5
|
1.0
|
O
|
A:HOH301
|
4.4
|
17.7
|
1.0
|
OD1
|
B:ASP40
|
4.5
|
16.1
|
1.0
|
OE1
|
B:GLU170
|
4.5
|
15.4
|
1.0
|
CA
|
B:THR171
|
4.5
|
17.1
|
1.0
|
OG1
|
B:THR172
|
4.7
|
15.3
|
1.0
|
CA
|
A:ILE24
|
4.7
|
13.9
|
1.0
|
N
|
A:ILE24
|
4.7
|
15.1
|
1.0
|
CG2
|
B:THR171
|
4.8
|
20.8
|
1.0
|
CA
|
B:GLY28
|
5.0
|
15.3
|
1.0
|
N
|
B:GLU29
|
5.0
|
16.4
|
1.0
|
|
Calcium binding site 4 out
of 4 in 8gz0
Go back to
Calcium Binding Sites List in 8gz0
Calcium binding site 4 out
of 4 in the Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 4 of Structure of Hypothetical Protein TTHA1873 with Phosphate From Thermus Thermophilus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Ca202
b:24.1
occ:1.00
|
OD1
|
B:ASP97
|
2.3
|
22.2
|
1.0
|
O
|
B:HOH370
|
2.3
|
17.0
|
1.0
|
O
|
B:GLY98
|
2.3
|
19.5
|
1.0
|
O
|
B:ALA103
|
2.4
|
24.5
|
1.0
|
OD1
|
B:ASP95
|
2.4
|
21.5
|
1.0
|
O
|
B:GLY101
|
2.5
|
23.7
|
1.0
|
OD2
|
B:ASP95
|
2.6
|
20.6
|
1.0
|
CG
|
B:ASP95
|
2.8
|
21.3
|
1.0
|
C
|
B:GLY98
|
3.4
|
20.1
|
1.0
|
C
|
B:ALA103
|
3.4
|
25.9
|
1.0
|
CG
|
B:ASP97
|
3.4
|
23.9
|
1.0
|
C
|
B:GLY101
|
3.5
|
25.5
|
1.0
|
N
|
B:ALA103
|
3.7
|
26.7
|
1.0
|
N
|
B:GLY98
|
3.8
|
21.4
|
1.0
|
CA
|
B:ALA103
|
4.0
|
26.9
|
1.0
|
CA
|
B:GLY98
|
4.1
|
20.0
|
1.0
|
OD2
|
B:ASP97
|
4.1
|
24.8
|
1.0
|
C
|
B:PRO102
|
4.1
|
27.1
|
1.0
|
C
|
B:ASP97
|
4.1
|
22.1
|
1.0
|
CB
|
B:ALA103
|
4.3
|
27.0
|
1.0
|
CB
|
B:ASP95
|
4.3
|
20.6
|
1.0
|
N
|
B:PRO102
|
4.4
|
26.6
|
1.0
|
N
|
B:GLY101
|
4.4
|
25.1
|
1.0
|
CA
|
B:PRO102
|
4.4
|
26.9
|
1.0
|
O
|
B:HOH395
|
4.4
|
38.5
|
1.0
|
CA
|
B:GLY101
|
4.5
|
26.1
|
1.0
|
O
|
B:HOH345
|
4.5
|
24.4
|
1.0
|
O
|
B:ASP97
|
4.5
|
22.3
|
1.0
|
N
|
B:PRO99
|
4.5
|
19.9
|
1.0
|
CB
|
B:ASP97
|
4.6
|
24.4
|
1.0
|
N
|
B:SER104
|
4.6
|
26.8
|
1.0
|
N
|
B:ASP97
|
4.6
|
23.5
|
1.0
|
CA
|
B:ASP97
|
4.6
|
23.4
|
1.0
|
O
|
B:PRO102
|
4.7
|
28.2
|
1.0
|
CA
|
B:PRO99
|
4.8
|
20.9
|
1.0
|
O
|
B:HOH358
|
4.9
|
17.5
|
1.0
|
CA
|
B:SER104
|
5.0
|
26.0
|
1.0
|
|
Reference:
I.Yuvaraj,
K.C.Santosh,
K.Sekar.
Structure of Hypothetical Protein TTHA1873 From Thermus Thermophilus at 1.78 Angstroms Resolution To Be Published.
Page generated: Fri Jul 19 09:20:01 2024
|