Calcium in PDB 7rr3: Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp
Protein crystallography data
The structure of Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp, PDB code: 7rr3
was solved by
L.Wang,
C.Yu,
P.Sliz,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
51.10 /
2.24
|
Space group
|
P 21 21 21
|
Cell size a, b, c (Å), α, β, γ (°)
|
56.452,
71.58,
72.962,
90,
90,
90
|
R / Rfree (%)
|
23.5 /
28.7
|
Calcium Binding Sites:
The binding sites of Calcium atom in the Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp
(pdb code 7rr3). This binding sites where shown within
5.0 Angstroms radius around Calcium atom.
In total 3 binding sites of Calcium where determined in the
Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp, PDB code: 7rr3:
Jump to Calcium binding site number:
1;
2;
3;
Calcium binding site 1 out
of 3 in 7rr3
Go back to
Calcium Binding Sites List in 7rr3
Calcium binding site 1 out
of 3 in the Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 1 of Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca301
b:40.4
occ:1.00
|
O
|
A:ASP72
|
2.3
|
41.9
|
1.0
|
O
|
A:GLU142
|
2.4
|
42.8
|
1.0
|
O
|
A:HOH417
|
2.4
|
37.2
|
1.0
|
O
|
A:THR69
|
2.5
|
42.3
|
1.0
|
C
|
A:GLU142
|
3.5
|
39.9
|
1.0
|
C
|
A:ASP72
|
3.6
|
42.7
|
1.0
|
C
|
A:THR69
|
3.6
|
43.6
|
1.0
|
O
|
A:PHE74
|
3.9
|
38.6
|
1.0
|
OD2
|
A:ASP72
|
4.0
|
45.9
|
1.0
|
N
|
A:THR69
|
4.3
|
39.4
|
1.0
|
CA
|
A:GLU142
|
4.3
|
43.0
|
1.0
|
CG
|
A:ASP72
|
4.3
|
45.6
|
1.0
|
N
|
A:PHE74
|
4.3
|
41.0
|
1.0
|
CA
|
A:PRO73
|
4.4
|
41.2
|
1.0
|
CB
|
A:SER143
|
4.4
|
40.8
|
1.0
|
N
|
A:PRO73
|
4.4
|
44.0
|
1.0
|
CB
|
A:GLU142
|
4.4
|
49.0
|
1.0
|
N
|
A:ASP72
|
4.4
|
46.1
|
1.0
|
CA
|
A:LYS70
|
4.4
|
44.8
|
1.0
|
OD1
|
A:ASP72
|
4.4
|
47.7
|
1.0
|
N
|
A:LYS70
|
4.4
|
39.2
|
1.0
|
N
|
A:SER143
|
4.5
|
38.4
|
1.0
|
C
|
A:PRO73
|
4.5
|
43.1
|
1.0
|
CA
|
A:ASP72
|
4.5
|
46.3
|
1.0
|
O
|
A:HOH409
|
4.6
|
42.6
|
1.0
|
CA
|
A:THR69
|
4.6
|
42.7
|
1.0
|
CA
|
A:SER143
|
4.6
|
43.1
|
1.0
|
C
|
A:LYS70
|
4.6
|
47.7
|
1.0
|
C
|
A:PHE74
|
4.8
|
38.9
|
1.0
|
CB
|
A:LEU68
|
4.9
|
39.6
|
1.0
|
C
|
A:LEU68
|
4.9
|
39.1
|
1.0
|
N
|
A:SER71
|
4.9
|
44.8
|
1.0
|
CG
|
A:GLU142
|
4.9
|
43.6
|
1.0
|
|
Calcium binding site 2 out
of 3 in 7rr3
Go back to
Calcium Binding Sites List in 7rr3
Calcium binding site 2 out
of 3 in the Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 2 of Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca302
b:58.2
occ:1.00
|
OE2
|
A:GLU139
|
2.5
|
58.6
|
1.0
|
OD2
|
A:ASP80
|
2.5
|
46.6
|
1.0
|
O
|
A:HOH422
|
2.8
|
56.2
|
1.0
|
O
|
A:HOH434
|
2.8
|
58.3
|
1.0
|
OD2
|
A:ASP78
|
2.8
|
44.1
|
1.0
|
O1A
|
A:DCT304
|
2.8
|
49.8
|
1.0
|
OD1
|
A:ASP80
|
3.2
|
46.4
|
1.0
|
CD
|
A:GLU139
|
3.2
|
56.6
|
1.0
|
CG
|
A:ASP80
|
3.2
|
44.9
|
1.0
|
O5'
|
A:DCT304
|
3.3
|
49.4
|
1.0
|
PA
|
A:DCT304
|
3.5
|
49.6
|
1.0
|
OE1
|
A:GLU139
|
3.7
|
56.7
|
1.0
|
O2A
|
A:DCT304
|
3.8
|
48.0
|
1.0
|
CA
|
A:CA303
|
4.0
|
43.0
|
1.0
|
CG
|
A:ASP78
|
4.1
|
40.8
|
1.0
|
C5'
|
A:DCT304
|
4.1
|
51.1
|
1.0
|
CG
|
A:GLU139
|
4.2
|
47.2
|
1.0
|
NZ
|
A:LYS129
|
4.4
|
60.0
|
1.0
|
CB
|
A:ASP80
|
4.7
|
45.3
|
1.0
|
OD1
|
A:ASP78
|
4.9
|
44.0
|
1.0
|
CB
|
A:ASP78
|
4.9
|
38.7
|
1.0
|
O3A
|
A:DCT304
|
5.0
|
48.5
|
1.0
|
|
Calcium binding site 3 out
of 3 in 7rr3
Go back to
Calcium Binding Sites List in 7rr3
Calcium binding site 3 out
of 3 in the Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp
Mono view
Stereo pair view
|
A full contact list of Calcium with other atoms in the Ca binding
site number 3 of Structure of Deep-Sea Phage Nrs-1 Primase-Polymerase N300 in Complex with Calcium and Ddctp within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Ca303
b:43.0
occ:1.00
|
O1G
|
A:DCT304
|
2.1
|
48.4
|
1.0
|
O1B
|
A:DCT304
|
2.3
|
43.5
|
1.0
|
OD1
|
A:ASP80
|
2.3
|
46.4
|
1.0
|
OD1
|
A:ASP78
|
2.3
|
44.0
|
1.0
|
O1A
|
A:DCT304
|
2.4
|
49.8
|
1.0
|
OD2
|
A:ASP78
|
2.5
|
44.1
|
1.0
|
CG
|
A:ASP78
|
2.8
|
40.8
|
1.0
|
CG
|
A:ASP80
|
3.5
|
44.9
|
1.0
|
PB
|
A:DCT304
|
3.5
|
41.4
|
1.0
|
PG
|
A:DCT304
|
3.5
|
51.9
|
1.0
|
PA
|
A:DCT304
|
3.7
|
49.6
|
1.0
|
NE2
|
A:HIS115
|
3.8
|
44.8
|
1.0
|
CA
|
A:CA302
|
4.0
|
58.2
|
1.0
|
O3B
|
A:DCT304
|
4.0
|
47.2
|
1.0
|
O3A
|
A:DCT304
|
4.1
|
48.5
|
1.0
|
OD2
|
A:ASP80
|
4.1
|
46.6
|
1.0
|
CD2
|
A:HIS115
|
4.2
|
41.9
|
1.0
|
CB
|
A:ASP78
|
4.3
|
38.7
|
1.0
|
O5'
|
A:DCT304
|
4.4
|
49.4
|
1.0
|
C5'
|
A:DCT304
|
4.4
|
51.1
|
1.0
|
O2G
|
A:DCT304
|
4.4
|
55.3
|
1.0
|
CA
|
A:ASP80
|
4.4
|
41.2
|
1.0
|
CB
|
A:SER108
|
4.4
|
41.4
|
1.0
|
CB
|
A:ASP80
|
4.5
|
45.3
|
1.0
|
O3G
|
A:DCT304
|
4.5
|
39.6
|
1.0
|
OG
|
A:SER108
|
4.5
|
40.4
|
1.0
|
N
|
A:ASP80
|
4.6
|
39.5
|
1.0
|
O
|
A:LEU79
|
4.6
|
42.2
|
1.0
|
C
|
A:LEU79
|
4.7
|
39.2
|
1.0
|
O2B
|
A:DCT304
|
4.7
|
52.1
|
1.0
|
O2A
|
A:DCT304
|
4.8
|
48.0
|
1.0
|
O
|
A:LEU114
|
4.9
|
43.3
|
1.0
|
N
|
A:LEU79
|
5.0
|
39.5
|
1.0
|
CA
|
A:ASP78
|
5.0
|
39.9
|
1.0
|
|
Reference:
F.Huang,
X.Lu,
C.Yu,
P.Sliz,
L.Wang,
B.Zhu.
Molecular Dissection of the Primase and Polymerase Activities of Deep-Sea Phage Nrs-1 Primase-Polymerase. Front Microbiol V. 12 66612 2021.
ISSN: ESSN 1664-302X
PubMed: 34975792
DOI: 10.3389/FMICB.2021.766612
Page generated: Fri Jul 19 03:48:59 2024
|