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Fluorine in PDB 5snh: Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394

Enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394

All present enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394:
2.3.1.179;

Protein crystallography data

The structure of Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394, PDB code: 5snh was solved by R.Brenk, C.Georgiou, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 84.23 / 1.95
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 137.424, 65.303, 84.368, 90, 93.28, 90
R / Rfree (%) 19.1 / 24.5

Fluorine Binding Sites:

The binding sites of Fluorine atom in the Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394 (pdb code 5snh). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total 3 binding sites of Fluorine where determined in the Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394, PDB code: 5snh:
Jump to Fluorine binding site number: 1; 2; 3;

Fluorine binding site 1 out of 3 in 5snh

Go back to Fluorine Binding Sites List in 5snh
Fluorine binding site 1 out of 3 in the Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F501

b:44.5
occ:1.00
F A:O1M501 0.0 44.5 1.0
C8 A:O1M501 1.3 45.6 1.0
C7 A:O1M501 2.4 44.8 1.0
C9 A:O1M501 2.4 44.2 1.0
CZ A:PHE400 3.0 22.0 1.0
CE2 A:PHE400 3.3 22.9 1.0
O A:HOH663 3.4 94.0 1.0
CD1 A:PHE203 3.4 19.5 1.0
CB A:ALA208 3.5 18.6 1.0
C10 A:O1M501 3.6 46.3 1.0
C6 A:O1M501 3.6 46.8 1.0
CE1 A:PHE203 3.6 19.4 1.0
CE1 A:PHE400 4.1 22.8 1.0
C5 A:O1M501 4.1 48.6 1.0
CB A:ALA206 4.2 24.1 1.0
CD2 A:PHE400 4.7 22.0 1.0
CG A:PHE203 4.7 19.9 1.0
CA A:PHE203 4.9 20.8 1.0
CG2 A:THR271 5.0 27.7 1.0
CZ A:PHE203 5.0 18.1 1.0
CA A:ALA208 5.0 19.3 1.0

Fluorine binding site 2 out of 3 in 5snh

Go back to Fluorine Binding Sites List in 5snh
Fluorine binding site 2 out of 3 in the Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 2 of Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F502

b:52.4
occ:1.00
F A:O1M502 0.0 52.4 1.0
C8 A:O1M502 1.3 51.5 1.0
C7 A:O1M502 2.4 52.1 1.0
C9 A:O1M502 2.4 50.2 1.0
C6 A:O1M502 3.6 51.0 1.0
C10 A:O1M502 3.7 49.8 1.0
O A:HOH746 3.9 19.3 1.0
C5 A:O1M502 4.1 49.8 1.0
NE2 A:GLN297 4.2 19.4 1.0
CD A:GLN297 4.5 18.3 1.0
OE1 A:GLN297 4.7 18.3 1.0

Fluorine binding site 3 out of 3 in 5snh

Go back to Fluorine Binding Sites List in 5snh
Fluorine binding site 3 out of 3 in the Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 3 of Pandda Analysis Group Deposition -- Crystal Structure of Pseudomonas Aeruginosa Fabf-C164Q Mutant Protein in Complex with Z198194394 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F501

b:47.1
occ:1.00
F B:O1M501 0.0 47.1 1.0
C8 B:O1M501 1.3 45.7 1.0
C7 B:O1M501 2.3 45.7 1.0
C9 B:O1M501 2.3 44.9 1.0
CZ B:PHE400 3.0 22.6 1.0
CB B:ALA208 3.0 25.2 1.0
CD1 B:PHE203 3.1 19.7 1.0
CE2 B:PHE400 3.3 25.1 1.0
CE1 B:PHE203 3.5 18.9 1.0
C6 B:O1M501 3.6 46.2 1.0
C10 B:O1M501 3.6 44.7 1.0
C5 B:O1M501 4.1 46.9 1.0
CB B:ALA206 4.1 22.2 1.0
CE1 B:PHE230 4.2 27.5 1.0
CG B:PHE203 4.3 19.7 1.0
CE1 B:PHE400 4.3 23.3 1.0
CA B:ALA208 4.5 24.3 1.0
CZ B:PHE230 4.5 28.3 1.0
CA B:PHE203 4.6 19.0 1.0
CD2 B:PHE400 4.6 25.1 1.0
CB B:PHE203 4.7 20.4 1.0
O B:PHE203 4.7 19.2 1.0
CZ B:PHE203 4.9 18.8 1.0
O B:HOH704 5.0 21.7 1.0

Reference:

R.Brenk, C.Georgiou. Pandda Analysis Group Deposition To Be Published.
Page generated: Tue Jul 15 07:31:41 2025

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