Chlorine in PDB 5j2h: Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus
Enzymatic activity of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus
All present enzymatic activity of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus:
2.7.7.7;
Protein crystallography data
The structure of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus, PDB code: 5j2h
was solved by
V.K.Batra,
S.H.Wilson,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
50.00 /
2.30
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
50.800,
79.700,
55.400,
90.00,
107.50,
90.00
|
R / Rfree (%)
|
20.5 /
26.6
|
Other elements in 5j2h:
The structure of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus
(pdb code 5j2h). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 5 binding sites of Chlorine where determined in the
Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus, PDB code: 5j2h:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
Chlorine binding site 1 out
of 5 in 5j2h
Go back to
Chlorine Binding Sites List in 5j2h
Chlorine binding site 1 out
of 5 in the Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl406
b:39.6
occ:1.00
|
N
|
A:CYS267
|
3.3
|
23.1
|
1.0
|
O
|
A:HOH560
|
3.3
|
19.6
|
1.0
|
C
|
A:GLN264
|
3.5
|
27.4
|
1.0
|
CA
|
A:GLN264
|
3.5
|
27.7
|
1.0
|
N
|
A:TYR266
|
3.5
|
25.4
|
1.0
|
O
|
A:GLN264
|
3.6
|
29.1
|
1.0
|
CB
|
A:TYR266
|
3.6
|
27.2
|
1.0
|
SG
|
A:CYS267
|
3.7
|
24.6
|
1.0
|
CB
|
A:VAL313
|
3.8
|
29.6
|
1.0
|
O
|
A:ASP263
|
3.9
|
31.8
|
1.0
|
CA
|
A:TYR266
|
3.9
|
25.0
|
1.0
|
CB
|
A:CYS267
|
3.9
|
25.4
|
1.0
|
C
|
A:TYR266
|
4.0
|
24.1
|
1.0
|
CG1
|
A:VAL313
|
4.0
|
30.5
|
1.0
|
N
|
A:TYR265
|
4.0
|
26.9
|
1.0
|
CA
|
A:CYS267
|
4.2
|
23.2
|
1.0
|
C
|
A:TYR265
|
4.4
|
26.8
|
1.0
|
CB
|
A:GLN264
|
4.5
|
28.4
|
1.0
|
N
|
A:GLN264
|
4.5
|
29.7
|
1.0
|
CD2
|
A:TYR266
|
4.5
|
29.6
|
1.0
|
O
|
A:VAL313
|
4.5
|
30.1
|
1.0
|
O
|
A:TYR296
|
4.5
|
23.7
|
1.0
|
O
|
A:HOH585
|
4.5
|
37.8
|
1.0
|
CG2
|
A:VAL313
|
4.5
|
28.6
|
1.0
|
C
|
A:ASP263
|
4.6
|
30.1
|
1.0
|
CG
|
A:TYR266
|
4.6
|
29.0
|
1.0
|
CA
|
A:TYR265
|
4.8
|
26.3
|
1.0
|
CG
|
A:GLN264
|
4.9
|
26.1
|
1.0
|
C
|
A:VAL313
|
4.9
|
31.7
|
1.0
|
CA
|
A:VAL313
|
5.0
|
30.3
|
1.0
|
|
Chlorine binding site 2 out
of 5 in 5j2h
Go back to
Chlorine Binding Sites List in 5j2h
Chlorine binding site 2 out
of 5 in the Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl407
b:37.0
occ:1.00
|
N
|
A:HIS34
|
3.2
|
29.3
|
1.0
|
CB
|
A:HIS34
|
3.3
|
31.5
|
1.0
|
C
|
A:ALA32
|
3.4
|
29.6
|
1.0
|
N
|
A:LYS35
|
3.4
|
28.2
|
1.0
|
O
|
A:ALA32
|
3.4
|
30.4
|
1.0
|
CB
|
A:ALA32
|
3.5
|
26.1
|
1.0
|
CA
|
A:ALA32
|
3.5
|
28.9
|
1.0
|
CA
|
A:HIS34
|
3.6
|
31.0
|
1.0
|
N
|
A:ILE33
|
3.9
|
29.9
|
1.0
|
CG
|
A:LYS35
|
3.9
|
26.0
|
1.0
|
C
|
A:HIS34
|
3.9
|
31.1
|
1.0
|
CG
|
A:HIS34
|
4.0
|
33.0
|
1.0
|
CD2
|
A:HIS34
|
4.1
|
34.0
|
1.0
|
C
|
A:ILE33
|
4.2
|
30.2
|
1.0
|
CB
|
A:LYS35
|
4.3
|
26.6
|
1.0
|
CA
|
A:LYS35
|
4.4
|
27.1
|
1.0
|
CA
|
A:ILE33
|
4.6
|
31.1
|
1.0
|
CD
|
A:LYS35
|
4.8
|
27.2
|
1.0
|
O6
|
D:DG1
|
4.9
|
26.7
|
1.0
|
N
|
A:ALA32
|
5.0
|
27.7
|
1.0
|
|
Chlorine binding site 3 out
of 5 in 5j2h
Go back to
Chlorine Binding Sites List in 5j2h
Chlorine binding site 3 out
of 5 in the Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl408
b:43.6
occ:1.00
|
N
|
A:LEU82
|
3.0
|
28.8
|
1.0
|
CA
|
A:LYS81
|
3.7
|
31.7
|
1.0
|
NH2
|
A:ARG89
|
3.7
|
45.3
|
1.0
|
NH1
|
A:ARG89
|
3.7
|
44.2
|
1.0
|
CB
|
A:LYS81
|
3.8
|
33.4
|
1.0
|
C
|
A:LYS81
|
3.8
|
30.9
|
1.0
|
O
|
A:LEU82
|
3.8
|
31.2
|
1.0
|
CA
|
A:LEU82
|
3.9
|
30.8
|
1.0
|
CB
|
A:LEU82
|
3.9
|
30.2
|
1.0
|
CB
|
A:LEU85
|
4.0
|
33.3
|
1.0
|
CZ
|
A:ARG89
|
4.1
|
44.6
|
1.0
|
CD1
|
A:LEU85
|
4.2
|
32.7
|
1.0
|
C
|
A:LEU82
|
4.3
|
31.1
|
1.0
|
CG
|
A:LEU85
|
4.7
|
33.7
|
1.0
|
O
|
A:LYS81
|
5.0
|
28.3
|
1.0
|
N
|
A:GLU86
|
5.0
|
35.3
|
1.0
|
|
Chlorine binding site 4 out
of 5 in 5j2h
Go back to
Chlorine Binding Sites List in 5j2h
Chlorine binding site 4 out
of 5 in the Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl409
b:41.2
occ:1.00
|
O
|
A:HOH663
|
2.8
|
29.3
|
1.0
|
NH2
|
A:ARG299
|
3.0
|
32.2
|
1.0
|
ND2
|
A:ASN294
|
3.4
|
25.9
|
1.0
|
NE
|
A:ARG299
|
3.4
|
32.6
|
1.0
|
OG1
|
A:THR297
|
3.4
|
30.1
|
1.0
|
CZ
|
A:ARG299
|
3.6
|
35.0
|
1.0
|
CB
|
A:TYR296
|
4.1
|
24.8
|
1.0
|
CD2
|
A:TYR296
|
4.1
|
24.3
|
1.0
|
CG
|
A:ASN294
|
4.3
|
27.9
|
1.0
|
OD1
|
A:ASN294
|
4.3
|
28.4
|
1.0
|
CG
|
A:TYR296
|
4.6
|
23.7
|
1.0
|
CD
|
A:ARG299
|
4.7
|
31.9
|
1.0
|
CB
|
A:THR297
|
4.7
|
29.6
|
1.0
|
O
|
T:HOH123
|
4.8
|
43.2
|
1.0
|
CG2
|
A:THR297
|
4.9
|
29.5
|
1.0
|
N
|
A:THR297
|
4.9
|
25.7
|
1.0
|
NH1
|
A:ARG299
|
5.0
|
36.4
|
1.0
|
|
Chlorine binding site 5 out
of 5 in 5j2h
Go back to
Chlorine Binding Sites List in 5j2h
Chlorine binding site 5 out
of 5 in the Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of Ternary Complex Crystal Structure of Dna Polymerase Beta with G:T Mismatch at the Primer Terminus within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl410
b:46.1
occ:1.00
|
OH
|
A:TYR271
|
3.2
|
28.1
|
1.0
|
NH1
|
A:ARG258
|
3.3
|
15.6
|
1.0
|
O3'
|
P:DT10
|
3.3
|
46.8
|
1.0
|
O
|
T:HOH114
|
3.8
|
37.9
|
1.0
|
CE1
|
A:PHE272
|
4.0
|
20.9
|
1.0
|
CD
|
A:LYS234
|
4.0
|
22.7
|
1.0
|
C3'
|
P:DT10
|
4.1
|
47.2
|
1.0
|
CZ
|
A:TYR271
|
4.2
|
22.8
|
1.0
|
C2'
|
P:DT10
|
4.2
|
46.6
|
1.0
|
CE2
|
A:TYR271
|
4.2
|
20.2
|
1.0
|
C4'
|
P:DT10
|
4.2
|
45.6
|
1.0
|
CZ
|
A:ARG258
|
4.5
|
16.0
|
1.0
|
CZ
|
A:PHE272
|
4.6
|
21.2
|
1.0
|
CD
|
A:ARG258
|
4.7
|
20.2
|
1.0
|
CD1
|
A:PHE272
|
4.8
|
20.7
|
1.0
|
CG
|
A:LYS234
|
4.9
|
20.7
|
1.0
|
O
|
P:HOH102
|
4.9
|
20.6
|
1.0
|
NZ
|
A:LYS234
|
5.0
|
27.2
|
1.0
|
|
Reference:
V.K.Batra,
W.A.Beard,
L.C.Pedersen,
S.H.Wilson.
Structures of Dna Polymerase Mispaired Dna Termini Transitioning to Pre-Catalytic Complexes Support An Induced-Fit Fidelity Mechanism. Structure V. 24 1863 2016.
ISSN: ISSN 0969-2126
PubMed: 27642161
DOI: 10.1016/J.STR.2016.08.006
Page generated: Fri Jul 26 09:41:53 2024
|