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Chlorine in PDB 4o5f: Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate

Enzymatic activity of Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate

All present enzymatic activity of Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate:
2.7.1.33;

Protein crystallography data

The structure of Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate, PDB code: 4o5f was solved by Seattle Structural Gemomics Center For Infectious Disease (Ssgcid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 50.00 / 1.55
Space group P 43 21 2
Cell size a, b, c (Å), α, β, γ (°) 99.440, 99.440, 112.900, 90.00, 90.00, 90.00
R / Rfree (%) 15.6 / 18.3

Other elements in 4o5f:

The structure of Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate also contains other interesting chemical elements:

Potassium (K) 2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate (pdb code 4o5f). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate, PDB code: 4o5f:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 4o5f

Go back to Chlorine Binding Sites List in 4o5f
Chlorine binding site 1 out of 2 in the Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl304

b:34.3
occ:1.00
O A:HOH694 2.8 48.2 1.0
N A:ASP136 3.2 20.0 1.0
CG A:ASP136 3.3 24.4 1.0
NE A:ARG134 3.4 24.7 1.0
CB A:ASP136 3.4 22.5 1.0
NH2 A:ARG134 3.5 28.0 1.0
CE1 A:HIS118 3.5 20.2 1.0
OD1 A:ASP136 3.6 22.2 1.0
OD2 A:ASP136 3.7 29.4 1.0
N A:ALA135 3.8 17.9 1.0
CB A:ARG134 3.8 18.3 1.0
CZ A:ARG134 3.8 26.3 1.0
CA A:ASP136 3.9 20.8 1.0
CB A:ALA135 4.0 19.0 1.0
C A:ALA135 4.0 19.2 1.0
NH2 A:ARG138 4.1 38.2 1.0
CA A:ALA135 4.1 18.5 1.0
ND1 A:HIS118 4.2 18.8 1.0
C A:ARG134 4.4 17.4 1.0
CD A:ARG134 4.4 21.9 1.0
CG A:ARG134 4.5 19.8 1.0
CA A:ARG134 4.6 16.9 1.0
NE2 A:HIS118 4.6 21.2 1.0

Chlorine binding site 2 out of 2 in 4o5f

Go back to Chlorine Binding Sites List in 4o5f
Chlorine binding site 2 out of 2 in the Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl305

b:24.8
occ:1.00
O A:HOH657 2.9 37.9 1.0
O B:HOH607 3.1 40.9 1.0
NE2 A:HIS158 3.4 23.3 1.0
NE2 B:HIS158 3.5 25.7 1.0
CD2 B:HIS158 3.5 23.3 1.0
O B:HOH602 3.5 26.9 0.5
CD2 A:HIS158 3.5 21.2 1.0
CB B:SER154 3.5 16.0 1.0
CB A:SER154 3.5 14.7 1.0
CE B:MET157 3.6 27.7 0.5
CA B:SER154 3.7 16.4 1.0
CA A:SER154 3.7 14.6 1.0
N B:SER154 4.5 16.7 1.0
N A:SER154 4.5 14.8 1.0
CD1 B:LEU150 4.6 19.3 1.0
CE1 A:HIS158 4.6 23.4 1.0
CE1 B:HIS158 4.8 26.0 1.0
CD1 A:LEU150 4.8 16.6 1.0
CG B:HIS158 4.8 22.9 1.0
C A:SER154 4.8 15.0 1.0
CG A:HIS158 4.8 20.6 1.0
C B:SER154 4.8 16.6 1.0
O A:SER154 4.9 15.6 1.0
CE A:MET157 4.9 23.3 0.5
OG B:SER154 4.9 15.3 1.0
OG A:SER154 4.9 14.2 1.0
O B:SER154 4.9 17.1 1.0

Reference:

J.Abendroth, D.M.Dranow, D.Lorimer, J.W.Fairman, T.E.Edwards, Seattle Structural Genomics Center For Infectious Disease(Ssgcid). Crystal Structure of Type III Pantothenate Kinase From Burkholderia Thailandensis in Complex with Pantothenate and Phosphate To Be Published.
Page generated: Thu Jul 25 23:14:02 2024

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