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Bromine 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:

Magnesium (Mg) 2 atoms
Fluorine (F) 1 atom

Bromine Binding Sites:

The binding sites of Bromine 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 Bromine atom.
In total only one binding site of Bromine was determined in the Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z2856434944, PDB code: 5sa1:

Bromine binding site 1 out of 1 in 5sa1

Go back to Bromine Binding Sites List in 5sa1
Bromine 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 Bromine with other atoms in the Br 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
B:Br506

b:97.9
occ:1.00
 NH2 B:ARG235 3.4 34.3 1.0
N B:LEU225 3.6 34.9 1.0
NE B:ARG228 3.6 54.8 0.3
N B:ASN224 3.7 40.0 1.0
CB B:ASN223 3.8 55.1 1.0
NH2 B:ARG228 3.8 56.3 0.3
O B:LEU225 3.9 33.5 1.0
CB B:ASN224 4.0 47.2 1.0
CB B:LEU225 4.1 36.2 1.0
CZ B:ARG228 4.2 55.8 0.3
CA B:ASN224 4.2 38.4 1.0
C B:ASN224 4.3 34.4 1.0
CA B:LEU225 4.4 34.1 1.0
CG B:ARG228 4.5 47.6 0.3
CZ B:ARG235 4.5 33.4 1.0
C B:ASN223 4.5 39.6 1.0
CG B:ASN223 4.6 66.9 1.0
C B:LEU225 4.6 30.8 1.0
CD B:ARG228 4.7 51.0 0.3
CA B:ASN223 4.7 46.6 1.0
NH1 B:ARG235 4.9 32.8 1.0
CE2 B:TYR221 4.9 48.1 1.0
CG B:ARG228 4.9 32.1 0.1

Reference:

A.Fiorillo, A.Ilari. Pandda Analysis Group Deposition To Be Published.
Page generated: Tue Apr 4 17:26:40 2023

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