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Bromine in PDB 5s9w: Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z26769872

Enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z26769872

All present enzymatic activity of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z26769872:
1.8.1.12;

Protein crystallography data

The structure of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z26769872, PDB code: 5s9w 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) 78.14 / 1.96
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 79.65, 109.11, 111.97, 90, 90, 90
R / Rfree (%) 19.6 / 24.7

Other elements in 5s9w:

The structure of Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z26769872 also contains other interesting chemical elements:

Fluorine (F) 2 atoms
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 Z26769872 (pdb code 5s9w). 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 Z26769872, PDB code: 5s9w:

Bromine binding site 1 out of 1 in 5s9w

Go back to Bromine Binding Sites List in 5s9w
Bromine binding site 1 out of 1 in the Pandda Analysis Group Deposition -- Crystal Structure of Trypanosoma Brucei Trypanothione Reductase in Complex with Z26769872


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 Z26769872 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Br507

b:88.8
occ:1.00
 NH2 B:ARG235 3.5 43.2 1.0
N B:ASN224 3.7 48.1 1.0
N B:LEU225 3.8 46.0 1.0
NE B:ARG228 3.8 63.3 0.3
CB B:ASN223 3.9 60.1 1.0
NH2 B:ARG228 4.1 67.8 0.3
O B:LEU225 4.1 38.7 1.0
CB B:ASN224 4.2 56.6 1.0
CB B:LEU225 4.2 48.2 1.0
CA B:ASN224 4.3 48.1 1.0
C B:ASN224 4.4 47.0 1.0
CZ B:ARG228 4.4 66.1 0.3
CA B:LEU225 4.5 44.8 1.0
CG B:ARG228 4.5 55.9 0.3
CZ B:ARG235 4.6 40.5 1.0
C B:ASN223 4.6 51.5 1.0
CG B:ASN223 4.7 69.9 1.0
CA B:ASN223 4.8 53.9 1.0
CD B:ARG228 4.8 60.7 0.3
C B:LEU225 4.8 41.9 1.0
NH1 B:ARG235 4.9 39.6 1.0
CG B:ARG228 5.0 44.6 0.1

Reference:

A.Fiorillo, A.Ilari. Pandda Analysis Group Deposition To Be Published.
Page generated: Mon Jul 7 09:06:14 2025

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