Chlorine in PDB 7pbg: 4-Ethylphenol Oxidase From Gulosibacter Chungangensis: Native Structure

The structure of 4-Ethylphenol Oxidase From Gulosibacter Chungangensis: Native Structure, PDB code: 7pbg was solved by L.Alvigini, A.Mattevi, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	44.23 / 1.60
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	151.134, 96.08, 87.636, 90, 115.65, 90
R / Rfree (%)	18.1 / 20.7

The binding sites of Chlorine atom in the 4-Ethylphenol Oxidase From Gulosibacter Chungangensis: Native Structure (pdb code 7pbg). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the 4-Ethylphenol Oxidase From Gulosibacter Chungangensis: Native Structure, PDB code: 7pbg:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the 4-Ethylphenol Oxidase From Gulosibacter Chungangensis: Native Structure


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of 4-Ethylphenol Oxidase From Gulosibacter Chungangensis: Native Structure within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl602 b:27.1 occ:1.00 O2' A:FAD601 3.1 21.7 1.0 N A:LEU153 3.2 20.3 1.0 C4X A:FAD601 3.2 20.2 1.0 C10 A:FAD601 3.3 18.4 1.0 N5 A:FAD601 3.3 21.1 1.0 N10 A:FAD601 3.4 19.7 1.0 C5X A:FAD601 3.4 19.8 1.0 N A:GLU152 3.4 21.4 1.0 C9A A:FAD601 3.5 17.3 1.0 CB A:ALA151 3.6 20.1 1.0 CB A:LEU153 3.6 21.2 1.0 C3' A:FAD601 3.7 18.7 1.0 CG A:LEU153 3.7 23.1 1.0 C2' A:FAD601 3.8 19.3 1.0 C4 A:FAD601 3.9 19.2 1.0 CA A:GLU152 4.0 24.1 1.0 C A:GLU152 4.0 21.7 1.0 CD1 A:LEU153 4.0 25.4 1.0 CA A:LEU153 4.0 19.9 1.0 N1 A:FAD601 4.0 17.9 1.0 CB A:GLU152 4.0 24.6 1.0 C A:ALA151 4.1 20.6 1.0 C1' A:FAD601 4.2 17.6 1.0 C6 A:FAD601 4.2 20.4 1.0 C9 A:FAD601 4.3 19.2 1.0 O4 A:FAD601 4.3 23.8 1.0 O A:LEU153 4.4 20.0 1.0 N3 A:FAD601 4.4 17.1 1.0 C4' A:FAD601 4.4 18.9 1.0 CA A:ALA151 4.5 20.0 1.0 O4' A:FAD601 4.5 22.2 1.0 C2 A:FAD601 4.5 15.6 1.0 O3' A:FAD601 4.7 18.6 1.0 C A:LEU153 4.7 19.3 1.0 O A:HOH861 4.8 25.3 1.0 C7 A:FAD601 4.9 19.9 1.0 C8 A:FAD601 4.9 19.0 1.0

Chlorine binding site 2 out of 2 in the 4-Ethylphenol Oxidase From Gulosibacter Chungangensis: Native Structure


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of 4-Ethylphenol Oxidase From Gulosibacter Chungangensis: Native Structure within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl602 b:26.6 occ:1.00 O2' B:FAD601 3.1 23.5 1.0 N B:LEU153 3.2 20.3 1.0 C4X B:FAD601 3.2 20.2 1.0 C10 B:FAD601 3.3 17.7 1.0 N10 B:FAD601 3.3 17.5 1.0 N5 B:FAD601 3.4 22.8 1.0 N B:GLU152 3.4 18.9 1.0 C5X B:FAD601 3.5 19.3 1.0 C9A B:FAD601 3.5 18.6 1.0 CB B:ALA151 3.5 21.6 1.0 CB B:LEU153 3.6 20.0 1.0 C3' B:FAD601 3.7 20.9 1.0 CG B:LEU153 3.8 22.3 1.0 C2' B:FAD601 3.8 22.3 1.0 C4 B:FAD601 3.9 20.5 1.0 CA B:GLU152 4.0 20.9 1.0 C B:GLU152 4.0 21.1 1.0 N1 B:FAD601 4.0 18.0 1.0 CA B:LEU153 4.0 19.9 1.0 CD1 B:LEU153 4.0 22.0 1.0 CB B:GLU152 4.0 23.1 1.0 C B:ALA151 4.2 20.8 1.0 C1' B:FAD601 4.2 18.0 1.0 C9 B:FAD601 4.3 19.4 1.0 C6 B:FAD601 4.3 19.6 1.0 O B:LEU153 4.4 21.4 1.0 O4' B:FAD601 4.4 23.4 1.0 O4 B:FAD601 4.4 24.2 1.0 CA B:ALA151 4.4 19.9 1.0 N3 B:FAD601 4.4 18.1 1.0 C4' B:FAD601 4.5 21.2 1.0 C2 B:FAD601 4.5 18.3 1.0 O3' B:FAD601 4.6 19.4 1.0 C B:LEU153 4.7 21.5 1.0 O B:HOH733 4.8 22.6 1.0 C8 B:FAD601 5.0 19.1 1.0

A.Laura, A.Gran-Scheuch, Y.Guo, M.Trajkovic, M.Saifuddin, M.W.Fraaije, A.Mattevi. Discovery, Biocatalytic Exploration and Structural Analysis of A 4-Ethylphenol Oxidase From Gulosibacter Chungangensis. Chembiochem 2021.
ISSN: ESSN 1439-7633
PubMed: 34523783
DOI: 10.1002/CBIC.202100457