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Chlorine in PDB 6crc: Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue

Enzymatic activity of Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue

All present enzymatic activity of Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue:
2.7.7.7;

Protein crystallography data

The structure of Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue, PDB code: 6crc 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) 19.98 / 2.30
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 54.437, 78.939, 54.911, 90.00, 108.55, 90.00
R / Rfree (%) 20.7 / 28.5

Other elements in 6crc:

The structure of Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue also contains other interesting chemical elements:

Magnesium (Mg) 1 atom
Sodium (Na) 3 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue (pdb code 6crc). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue, PDB code: 6crc:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 6crc

Go back to Chlorine Binding Sites List in 6crc
Chlorine binding site 1 out of 2 in the Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue


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 A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl401

b:52.7
occ:1.00
CL1 A:VA7401 0.0 52.7 1.0
C3B A:VA7401 1.8 39.2 1.0
O2G A:VA7401 2.8 42.1 1.0
PG A:VA7401 2.8 44.1 1.0
CL2 A:VA7401 2.9 58.4 1.0
PB A:VA7401 3.0 40.0 1.0
O2B A:VA7401 3.0 35.5 1.0
O3G A:VA7401 3.5 41.0 1.0
NH2 A:ARG183 3.6 36.7 1.0
CB A:SER180 3.9 33.5 1.0
O1B A:VA7401 3.9 37.6 1.0
O3A A:VA7401 4.1 39.9 1.0
O1G A:VA7401 4.1 34.2 1.0
OG A:SER180 4.3 31.0 1.0
CZ A:ARG183 4.5 40.1 1.0
NH1 A:ARG183 4.5 37.2 1.0
NH1 A:ARG149 4.9 36.1 1.0
CA A:SER180 4.9 33.5 1.0
N A:SER180 5.0 36.5 1.0

Chlorine binding site 2 out of 2 in 6crc

Go back to Chlorine Binding Sites List in 6crc
Chlorine binding site 2 out of 2 in the Ternary Complex Crystal Structure of Dna Polymerase Beta with A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue


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 A Dideoxy Terminated Primer with CCL2, Beta, Gamma Datp Analogue within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl401

b:58.4
occ:1.00
CL2 A:VA7401 0.0 58.4 1.0
C3B A:VA7401 1.7 39.2 1.0
PG A:VA7401 2.8 44.1 1.0
O1G A:VA7401 2.9 34.2 1.0
PB A:VA7401 2.9 40.0 1.0
CL1 A:VA7401 2.9 52.7 1.0
O3A A:VA7401 2.9 39.9 1.0
O A:HOH536 3.1 32.3 1.0
O2A A:VA7401 3.3 33.0 1.0
O2G A:VA7401 3.3 42.1 1.0
PA A:VA7401 3.5 32.7 1.0
O1A A:VA7401 3.9 35.9 1.0
O2B A:VA7401 3.9 35.5 1.0
O1B A:VA7401 3.9 37.6 1.0
O3G A:VA7401 4.2 41.0 1.0

Reference:

V.K.Batra, K.Oertell, W.A.Beard, B.A.Kashemirov, C.E.Mckenna, M.F.Goodman, S.H.Wilson. Mapping Functional Substrate-Enzyme Interactions in the Pol Beta Active Site Through Chemical Biology: Structural Responses to Acidity Modification of Incoming Dntps. Biochemistry V. 57 3934 2018.
ISSN: ISSN 1520-4995
PubMed: 29874056
DOI: 10.1021/ACS.BIOCHEM.8B00418
Page generated: Sat Jul 12 12:32:05 2025

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