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Sodium in PDB 5j0s: Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus

Enzymatic activity of Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus

All present enzymatic activity of Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus:
2.7.7.7;

Protein crystallography data

The structure of Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus, PDB code: 5j0s 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 / 2.00
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 54.560, 79.530, 54.890, 90.00, 105.68, 90.00
R / Rfree (%) 19.9 / 24.6

Sodium Binding Sites:

The binding sites of Sodium atom in the Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus (pdb code 5j0s). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 4 binding sites of Sodium where determined in the Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus, PDB code: 5j0s:
Jump to Sodium binding site number: 1; 2; 3; 4;

Sodium binding site 1 out of 4 in 5j0s

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Sodium binding site 1 out of 4 in the Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na401

b:9.1
occ:1.00
O A:THR101 2.2 11.5 1.0
O A:ILE106 2.4 9.0 1.0
OP1 P:DG9 2.5 9.9 1.0
O P:HOH114 2.5 9.2 1.0
O A:VAL103 2.6 13.0 1.0
O A:HOH753 2.6 13.6 1.0
C A:THR101 3.2 11.7 1.0
C A:ILE106 3.4 9.4 1.0
NA A:NA403 3.4 25.4 1.0
C A:VAL103 3.4 12.1 1.0
P P:DG9 3.5 11.7 1.0
OP2 P:DG9 3.6 9.0 1.0
N A:ILE106 3.8 7.4 1.0
CA A:THR101 3.8 11.7 1.0
CA A:SER104 4.0 10.9 1.0
N A:VAL103 4.0 12.2 1.0
N A:GLY105 4.0 8.7 1.0
CA A:ILE106 4.0 8.0 1.0
N A:SER104 4.1 12.0 1.0
O P:HOH134 4.2 45.4 1.0
N A:ARG102 4.3 13.9 1.0
C A:ARG102 4.3 13.2 1.0
CB A:THR101 4.3 11.5 1.0
N A:GLY107 4.3 9.0 1.0
C A:SER104 4.4 9.9 1.0
CA A:VAL103 4.4 13.1 1.0
CB A:ILE106 4.4 11.4 1.0
O3' P:DC8 4.5 13.0 1.0
CA A:GLY107 4.5 9.7 1.0
CA A:ARG102 4.6 13.2 1.0
O5' P:DG9 4.7 13.1 1.0
C A:GLY105 4.7 7.5 1.0
O A:ARG102 4.8 11.7 1.0
O A:LEU100 4.8 11.8 1.0
O A:HOH540 4.9 31.4 1.0
O A:HOH712 5.0 17.8 1.0
CA A:GLY105 5.0 7.4 1.0

Sodium binding site 2 out of 4 in 5j0s

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Sodium binding site 2 out of 4 in the Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na402

b:18.2
occ:1.00
O A:VAL65 2.2 19.9 1.0
O D:HOH116 2.3 16.6 1.0
O A:LYS60 2.4 23.1 1.0
O A:LEU62 2.6 18.6 1.0
O A:HOH765 2.7 23.7 1.0
OP1 D:DC3 2.7 18.0 1.0
C A:VAL65 3.2 17.7 1.0
C A:LYS60 3.5 23.3 1.0
C A:LEU62 3.5 20.7 1.0
N A:VAL65 3.6 15.7 1.0
P D:DC3 3.7 17.2 1.0
CA A:VAL65 3.9 16.1 1.0
OP2 D:DC3 3.9 17.2 1.0
N A:GLY64 4.0 19.0 1.0
CA A:LYS60 4.1 21.3 1.0
CA A:PRO63 4.2 20.1 1.0
N A:LEU62 4.2 21.7 1.0
CB A:VAL65 4.2 14.2 1.0
CG A:LYS60 4.2 23.0 1.0
N A:PRO63 4.2 20.8 1.0
C A:LYS61 4.3 23.4 1.0
N A:GLY66 4.3 17.1 1.0
N A:LYS61 4.5 24.6 1.0
CA A:LEU62 4.5 20.7 1.0
C A:PRO63 4.5 18.9 1.0
O3' D:DT2 4.5 16.4 1.0
O A:LYS61 4.6 24.5 1.0
C A:GLY64 4.6 16.3 1.0
CA A:GLY66 4.6 16.5 1.0
CA A:LYS61 4.7 23.8 1.0
CB A:LYS60 4.8 22.1 1.0
O A:ALA59 4.8 20.9 1.0
NZ A:LYS60 4.8 24.6 1.0
CA A:GLY64 5.0 16.6 1.0
CG1 A:VAL65 5.0 14.7 1.0

Sodium binding site 3 out of 4 in 5j0s

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Sodium binding site 3 out of 4 in the Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 3 of Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na403

b:25.4
occ:1.00
O A:HOH888 2.3 22.8 1.0
O A:HOH712 2.3 17.8 1.0
O A:THR101 2.7 11.5 1.0
O A:HOH846 2.7 22.2 1.0
O A:HOH753 2.7 13.6 1.0
O P:HOH114 2.7 9.2 1.0
NA A:NA401 3.4 9.1 1.0
C A:THR101 3.6 11.7 1.0
O P:HOH134 3.9 45.4 1.0
CA A:ARG102 4.0 13.2 1.0
N A:ARG102 4.1 13.9 1.0
NZ A:LYS27 4.3 31.2 1.0
CB A:THR101 4.4 11.5 1.0
OG1 A:THR101 4.5 13.4 1.0
C A:ARG102 4.5 13.2 1.0
CA A:THR101 4.6 11.7 1.0
O A:HOH896 4.6 22.2 1.0
O A:HOH540 4.6 31.4 1.0
O A:ARG102 4.8 11.7 1.0
O A:HOH511 4.9 18.1 1.0
OP2 P:DG9 5.0 9.0 1.0

Sodium binding site 4 out of 4 in 5j0s

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Sodium binding site 4 out of 4 in the Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 4 of Binary Complex Crystal Structure of Dna Polymerase Beta with C:T Mismatch at the Primer Terminus within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na404

b:22.8
occ:1.00
O A:HOH762 2.2 18.1 1.0
OG A:SER171 2.3 12.4 1.0
O A:HOH673 2.3 16.3 1.0
CB A:SER171 3.5 15.4 1.0
N A:SER171 3.9 14.1 1.0
O A:HOH867 4.1 30.1 1.0
CA A:SER171 4.3 14.8 1.0
O A:HOH598 4.3 19.7 1.0
O A:HOH865 4.5 38.7 1.0
OD1 A:ASP170 4.6 14.1 1.0
O A:HOH642 5.0 21.1 1.0
C A:SER171 5.0 16.5 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: Mon Oct 7 21:45:31 2024

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