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Bromine in PDB 5s9t: Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z1614545742

Enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z1614545742

All present enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z1614545742:
1.8.1.12;

Protein crystallography data

The structure of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z1614545742, PDB code: 5s9t 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) 78.10 / 1.66
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 80.35, 108.9, 112.07, 90, 90, 90
R / Rfree (%) 18.8 / 22.1

Other elements in 5s9t:

The structure of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z1614545742 also contains other interesting chemical elements:

Magnesium (Mg) 2 atoms

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 Z1614545742 (pdb code 5s9t). 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 Z1614545742, PDB code: 5s9t:

Bromine binding site 1 out of 1 in 5s9t

Go back to Bromine Binding Sites List in 5s9t
Bromine binding site 1 out of 1 in the Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z1614545742


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 Z1614545742 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Br507

b:66.8
occ:1.00
 NE B:ARG228 3.5 28.7 0.3
NH2 B:ARG235 3.5 27.1 1.0
NH2 B:ARG228 3.6 30.1 0.3
N B:ASN224 3.8 33.7 1.0
N B:LEU225 3.8 29.7 1.0
CB B:ASN223 3.9 43.3 1.0
CZ B:ARG228 4.0 29.5 0.3
O B:LEU225 4.1 26.9 1.0
CB B:ASN224 4.2 38.9 1.0
CB B:LEU225 4.2 28.8 1.0
CA B:ASN224 4.3 30.2 1.0
CG B:ARG228 4.4 27.5 0.3
C B:ASN224 4.4 30.3 1.0
CA B:LEU225 4.5 27.3 1.0
CD B:ARG228 4.5 28.1 0.3
CZ B:ARG235 4.6 28.9 1.0
C B:ASN223 4.7 34.6 1.0
C B:LEU225 4.8 25.6 1.0
CG B:ASN223 4.8 46.8 1.0
CA B:ASN223 4.8 35.5 1.0
NH1 B:ARG235 4.9 29.4 1.0

Reference:

A.Fiorillo, A.Ilari. Pandda Analysis Group Deposition To Be Published.
Page generated: Mon Jul 7 09:05:51 2025

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