Chlorine in PDB 3ihv: Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution

The structure of Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution, PDB code: 3ihv was solved by Joint Center For Structural Genomics (Jcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.75 / 1.70
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	62.908, 72.318, 131.629, 90.00, 97.31, 90.00
R / Rfree (%)	16.2 / 19.3

The structure of Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution also contains other interesting chemical elements:

Sodium

(Na)

4 atoms

The binding sites of Chlorine atom in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution (pdb code 3ihv). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution, PDB code: 3ihv:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1 b:16.6 occ:1.00 O A:HOH759 3.1 8.9 1.0 O A:HOH778 3.1 13.1 1.0 O A:HOH796 3.3 13.9 1.0 N A:PHE487 3.4 7.2 1.0 N A:GLY489 3.4 8.8 1.0 CA A:PHE487 3.5 7.7 1.0 C A:PHE487 3.7 7.6 1.0 N A:ARG491 3.7 7.2 1.0 N A:HIS490 3.8 8.5 1.0 CA A:GLY489 3.8 9.4 1.0 CB A:ARG491 3.8 7.0 1.0 N A:GLU488 3.8 7.6 1.0 CD1 A:ILE73 3.9 8.9 1.0 C A:GLY489 4.1 9.1 1.0 O A:HOH789 4.2 12.5 1.0 O A:HOH872 4.3 25.3 1.0 O A:PHE487 4.3 8.3 1.0 CA A:ARG491 4.4 8.1 1.0 O A:ASN68 4.4 10.7 1.0 C A:GLU488 4.5 7.7 1.0 C A:SER486 4.5 7.3 1.0 CG1 A:ILE73 4.7 9.3 1.0 C A:HIS490 4.7 9.0 1.0 O A:LEU485 4.7 6.7 1.0 CA A:HIS490 4.8 8.1 1.0 CA A:GLU488 4.8 7.0 1.0 OG A:SER74 4.9 9.1 1.0 CB A:PHE487 4.9 7.2 1.0

Chlorine binding site 2 out of 4 in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl4 b:24.6 occ:1.00 O A:HOH987 2.9 14.2 1.0 OH A:TYR138 2.9 8.3 1.0 O A:HOH1044 3.1 12.1 1.0 NH1 A:ARG214 3.3 10.0 1.0 NH2 A:ARG214 3.3 8.9 1.0 CD A:LYS43 3.4 17.6 1.0 CE1 A:TYR138 3.5 7.1 1.0 CZ A:TYR138 3.6 8.2 1.0 CG A:ARG208 3.7 6.2 1.0 CZ A:ARG214 3.7 9.8 1.0 CB A:ARG208 3.9 8.4 1.0 O A:HOH1274 4.0 38.7 1.0 CG A:LYS43 4.1 12.7 1.0 CD A:ARG208 4.2 7.0 1.0 CA A:ARG208 4.2 8.9 1.0 N A:GLU209 4.5 12.3 1.0 O A:HOH1038 4.6 11.7 1.0 O A:SER210 4.6 12.3 1.0 CE A:LYS43 4.7 22.4 1.0 NZ A:LYS43 4.7 25.8 1.0 CD1 A:TYR138 4.7 6.4 1.0 CD2 A:LEU134 4.8 6.7 1.0 C A:ARG208 4.9 10.4 1.0 CE2 A:TYR138 4.9 7.1 1.0 CB A:LYS43 5.0 9.1 1.0

Chlorine binding site 3 out of 4 in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl2 b:16.9 occ:1.00 O B:HOH769 3.0 10.4 1.0 O B:HOH744 3.1 11.2 1.0 N B:GLY489 3.3 8.5 1.0 N B:PHE487 3.3 7.9 1.0 O B:HOH779 3.3 10.7 1.0 CA B:PHE487 3.4 7.9 1.0 C B:PHE487 3.7 8.7 1.0 N B:ARG491 3.7 8.1 1.0 CB B:ARG491 3.8 6.9 1.0 N B:HIS490 3.8 6.7 1.0 CA B:GLY489 3.8 9.2 1.0 N B:GLU488 3.8 7.4 1.0 CD1 B:ILE73 3.9 8.3 1.0 O B:HOH759 4.1 25.0 1.0 C B:GLY489 4.1 8.3 1.0 O B:HOH821 4.2 14.3 1.0 O B:PHE487 4.3 8.4 1.0 CA B:ARG491 4.4 7.2 1.0 C B:GLU488 4.4 8.2 1.0 C B:SER486 4.5 7.7 1.0 O B:ASN68 4.5 11.0 1.0 CG1 B:ILE73 4.6 9.7 1.0 C B:HIS490 4.7 7.2 1.0 CA B:GLU488 4.7 7.9 1.0 O B:LEU485 4.7 7.3 1.0 CA B:HIS490 4.8 7.2 1.0 CB B:PHE487 4.8 7.7 1.0 OG B:SER74 4.8 9.0 1.0

Chlorine binding site 4 out of 4 in the Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Crystal Structure of Susd Homolog (NP_813570.1) From Bacteroides Thetaiotaomicron Vpi-5482 at 1.70 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl3 b:24.0 occ:1.00 OH B:TYR138 2.9 9.2 1.0 O B:HOH572 3.0 16.0 1.0 O B:HOH870 3.0 12.7 1.0 NH1 B:ARG214 3.3 11.1 1.0 NH2 B:ARG214 3.3 7.6 1.0 CD B:LYS43 3.4 17.7 1.0 CE1 B:TYR138 3.5 8.0 1.0 CZ B:TYR138 3.6 7.4 1.0 CG B:ARG208 3.6 7.3 1.0 CB B:ARG208 3.7 8.8 1.0 CZ B:ARG214 3.8 9.1 1.0 CD B:ARG208 4.2 6.2 1.0 CG B:LYS43 4.2 13.3 1.0 CA B:ARG208 4.2 9.6 1.0 O B:HOH1173 4.2 32.7 1.0 N B:GLU209 4.5 12.5 1.0 O B:HOH846 4.5 11.2 1.0 NZ B:LYS43 4.6 26.3 1.0 O B:SER210 4.6 13.5 1.0 CE B:LYS43 4.6 22.2 1.0 CD2 B:LEU134 4.7 6.3 1.0 CD1 B:TYR138 4.7 5.6 1.0 C B:ARG208 4.8 10.8 1.0 CE2 B:TYR138 4.9 5.9 1.0 CB B:LYS43 5.0 8.9 1.0

Joint Center For Structural Genomics (Jcsg), Joint Center For Structural Genomics (Jcsg). N/A N/A.