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Fluorine in PDB 5sa1: Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944

Enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944

All present enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944:
1.8.1.12;

Protein crystallography data

The structure of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944, PDB code: 5sa1 was solved by A.Fiorillo, A.Ilari, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 56.09 / 1.84
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 80.06, 109.06, 112.05, 90, 90, 90
R / Rfree (%) 19.2 / 23.2

Other elements in 5sa1:

The structure of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944 also contains other interesting chemical elements:

Bromine (Br) 1 atom
Magnesium (Mg) 2 atoms

Fluorine Binding Sites:

The binding sites of Fluorine atom in the Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944 (pdb code 5sa1). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total only one binding site of Fluorine was determined in the Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944, PDB code: 5sa1:

Fluorine binding site 1 out of 1 in 5sa1

Go back to Fluorine Binding Sites List in 5sa1
Fluorine binding site 1 out of 1 in the Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944


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 Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:F509

b:47.8
occ:1.00
F1 A:AWD509 0.0 47.8 1.0
C10 A:AWD509 1.4 48.9 1.0
C9 A:AWD509 2.3 46.4 1.0
C11 A:AWD509 2.3 49.2 1.0
O B:HOH650 3.1 35.0 1.0
ND2 A:ASN402 3.2 44.1 1.0
O A:HOH757 3.3 37.1 1.0
C8 A:AWD509 3.6 48.4 1.0
C12 A:AWD509 3.6 49.9 1.0
O B:HOH728 4.0 30.5 1.0
CD1 A:LEU399 4.0 37.2 1.0
C7 A:AWD509 4.1 50.7 1.0
CG A:ASN402 4.4 41.4 1.0
O A:HOH638 4.6 34.9 1.0
CA A:LEU399 5.0 30.6 1.0

Reference:

A.Fiorillo, A.Ilari. Pandda Analysis Group Deposition To Be Published.
Page generated: Tue Apr 4 23:41:20 2023

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