Chlorine in PDB 5v8s: Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima

The structure of Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima, PDB code: 5v8s was solved by A.B.Taylor, A.Becker, N.Giri, P.J.Hart, D.M.Kurtz Jr., with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	84.98 / 1.41
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	54.616, 91.857, 85.479, 90.00, 96.20, 90.00
R / Rfree (%)	15.1 / 17.8

The structure of Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima also contains other interesting chemical elements:

Iron

(Fe)

4 atoms

The binding sites of Chlorine atom in the Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima (pdb code 5v8s). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima, PDB code: 5v8s:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl402 b:23.4 occ:1.00 N A:TYR264 3.1 26.9 1.0 OH A:TYR318 3.2 25.1 1.0 N A:PHE266 3.3 23.2 1.0 N A:VAL267 3.4 18.8 1.0 N A:GLY265 3.4 26.8 1.0 N A:MET263 3.5 24.5 1.0 CG2 A:VAL267 3.8 18.9 1.0 CA A:TYR264 3.8 28.3 1.0 CB A:PHE266 3.9 24.9 1.0 OG A:SER262 3.9 21.8 1.0 CA A:PHE266 3.9 22.5 1.0 C A:TYR264 4.0 28.5 1.0 CB A:TYR264 4.0 30.2 1.0 C A:SER262 4.0 21.8 1.0 OG A:SER316 4.1 23.1 1.0 CD2 A:TYR264 4.1 32.3 1.0 CA A:SER262 4.1 19.8 1.0 CZ A:TYR318 4.1 25.0 1.0 C A:MET263 4.1 25.8 1.0 CB A:VAL267 4.1 17.6 1.0 C A:PHE266 4.1 20.6 1.0 C A:GLY265 4.1 23.8 1.0 CE2 A:TYR318 4.2 24.7 1.0 CA A:MET263 4.2 27.6 1.0 CA A:GLY265 4.3 26.1 1.0 CA A:VAL267 4.4 18.4 1.0 CD2 A:PHE266 4.4 29.0 1.0 CB A:MET263 4.4 29.8 1.0 CG A:TYR264 4.4 32.0 1.0 CB A:SER262 4.6 21.2 1.0 CG A:PHE266 4.6 27.4 1.0 O A:SER262 5.0 22.0 1.0

Chlorine binding site 2 out of 3 in the Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl405 b:17.3 occ:1.00 NE A:ARG327 3.2 18.3 1.0 NE B:ARG327 3.3 18.3 1.0 NH2 B:ARG327 3.3 19.1 1.0 NH2 A:ARG327 3.4 18.9 1.0 CA B:PHE328 3.7 15.0 1.0 CD1 B:PHE328 3.7 17.2 1.0 CZ B:ARG327 3.8 19.4 1.0 CD1 A:PHE328 3.8 18.0 1.0 CZ A:ARG327 3.8 18.5 1.0 CA A:PHE328 3.9 15.6 1.0 CB B:PHE328 3.9 16.3 1.0 CD1 A:LEU331 3.9 18.4 1.0 CD1 B:LEU331 4.0 17.5 1.0 CB A:PHE328 4.0 16.4 1.0 N B:PHE328 4.1 15.5 1.0 N A:PHE328 4.2 16.4 1.0 CG B:PHE328 4.3 15.6 1.0 CD A:ARG327 4.3 18.6 1.0 CG A:PHE328 4.4 17.9 1.0 CD B:ARG327 4.4 17.6 1.0 CG A:ARG327 4.6 17.2 1.0 CG B:ARG327 4.6 17.2 1.0 C B:ARG327 4.7 16.4 1.0 C A:ARG327 4.7 16.0 1.0 CE1 A:PHE328 4.8 17.9 1.0 CE1 B:PHE328 4.8 16.7 1.0 O B:ARG327 4.9 17.3 1.0 O A:ARG327 4.9 16.4 1.0

Chlorine binding site 3 out of 3 in the Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Flavo Di-Iron Protein H90D Mutant From Thermotoga Maritima within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl402 b:29.8 occ:1.00 O B:HOH532 3.1 64.3 1.0 N B:TYR264 3.2 27.6 1.0 N B:PHE266 3.3 26.1 1.0 N B:MET263 3.3 26.5 1.0 N B:VAL267 3.4 21.8 1.0 N B:GLY265 3.7 28.1 1.0 CB B:PHE266 3.7 27.2 1.0 OG B:SER262 3.8 25.4 1.0 CG2 B:VAL267 3.9 21.4 1.0 CA B:PHE266 3.9 25.8 1.0 CA B:MET263 4.0 28.9 1.0 CA B:TYR264 4.1 27.6 1.0 C B:TYR264 4.1 28.3 1.0 CB B:MET263 4.1 32.4 1.0 C B:MET263 4.1 29.5 1.0 C B:PHE266 4.1 24.0 1.0 C B:SER262 4.2 23.7 1.0 CA B:SER262 4.2 21.1 1.0 CD2 B:PHE266 4.2 31.0 1.0 CB B:VAL267 4.2 19.9 1.0 C B:GLY265 4.2 26.5 1.0 CB B:TYR264 4.4 27.1 1.0 CA B:VAL267 4.4 20.7 1.0 CG B:PHE266 4.5 29.3 1.0 CA B:GLY265 4.5 27.3 1.0 OG B:SER316 4.6 28.5 1.0 CB B:SER262 4.6 23.5 1.0 CG B:MET263 4.9 37.0 1.0

D.M.Kurtz Jr., A.B.Taylor, A.Becker, N.Giri, P.J.Hart, D.M.Kurtz Jr.. N/A N/A.