Chlorine in PDB 3gxh: Crystal Structure of Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 A Resolution

The structure of Crystal Structure of Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 A Resolution, PDB code: 3gxh 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)	48.85 / 1.40
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	57.303, 57.528, 92.364, 90.00, 90.00, 90.00
R / Rfree (%)	15.9 / 17.9

The binding sites of Chlorine atom in the Crystal Structure of Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 A Resolution (pdb code 3gxh). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Crystal Structure of Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 A Resolution, PDB code: 3gxh:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Crystal Structure of Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 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 Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1 b:12.9 occ:1.00 O A:HOH326 3.2 14.4 0.5 O A:HOH326 3.2 14.2 0.5 N B:GLU51 3.3 9.4 1.0 N A:GLU51 3.3 11.1 1.0 CB A:ASN50 3.6 10.6 1.0 CB B:ASN50 3.6 9.3 1.0 CE1 A:HIS77 3.8 9.7 1.0 CE1 B:HIS77 3.8 10.7 1.0 CB B:GLU51 3.8 11.3 1.0 CA A:ASN50 3.9 10.7 1.0 CA B:ASN50 3.9 10.4 1.0 CB A:GLU51 3.9 11.0 1.0 C B:ASN50 4.1 9.7 1.0 C A:ASN50 4.1 10.7 1.0 CA B:GLU51 4.2 11.6 1.0 CA A:GLU51 4.2 10.9 1.0 ND1 A:HIS77 4.4 11.4 1.0 ND1 B:HIS77 4.4 10.3 1.0 OE1 A:GLN52 4.4 17.3 1.0 OE1 B:GLN52 4.5 19.0 1.0 O A:HOH220 4.7 20.8 1.0 O B:HOH225 4.7 17.8 1.0 CG A:ASN50 4.7 12.3 1.0 CG B:ASN50 4.8 13.7 1.0 NE2 A:HIS77 4.9 11.0 1.0 NE2 B:HIS77 4.9 11.5 1.0

Chlorine binding site 2 out of 3 in the Crystal Structure of Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 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 Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl2 b:39.9 occ:1.00 O B:HOH238 2.6 33.0 1.0 O3 A:SO46 2.8 18.0 0.5 N B:ALA35 3.1 9.9 1.0 O A:HOH227 3.3 22.4 1.0 O1 A:SO46 3.3 35.3 0.5 S A:SO46 3.6 22.5 0.5 NH2 A:ARG34 3.6 12.3 1.0 CA B:ALA35 3.7 10.4 1.0 NE A:ARG34 4.0 11.1 1.0 C B:ARG34 4.0 10.8 1.0 O B:HOH336 4.0 12.1 0.5 CA B:ARG34 4.0 9.6 1.0 O2 A:SO46 4.1 28.7 0.5 CZ A:ARG34 4.1 10.7 1.0 O3 A:SO47 4.1 28.1 0.5 CG B:ARG34 4.1 12.0 1.0 CB B:ALA35 4.2 10.3 1.0 O B:HOH363 4.3 26.2 1.0 O2 A:SO47 4.6 34.6 0.5 CB B:ARG34 4.6 11.8 1.0 O B:HOH378 4.7 18.8 0.5 O4 A:SO46 4.8 20.8 0.5 O B:HOH326 5.0 24.0 1.0

Chlorine binding site 3 out of 3 in the Crystal Structure of Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 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 Putative Phosphatase (DUF442) (YP_001181608.1) From Shewanella Putrefaciens Cn-32 at 1.40 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl3 b:44.1 occ:1.00 N B:LYS74 3.2 13.2 1.0 O B:HOH387 3.3 17.7 0.5 CG B:LYS74 3.6 26.3 1.0 CA B:SER73 3.7 11.9 0.5 OG B:SER73 3.7 13.3 0.5 CA B:SER73 3.7 12.2 0.5 CD B:LYS74 3.8 32.6 1.0 CB B:LYS74 3.9 17.3 1.0 C B:SER73 4.0 11.6 1.0 NZ B:LYS74 4.0 33.1 1.0 CB B:SER73 4.1 12.4 0.5 CB B:SER73 4.2 12.3 0.5 CA B:LYS74 4.2 14.8 1.0 CE B:LYS74 4.5 24.9 1.0 O B:HOH203 4.6 31.3 1.0 OG B:SER73 4.7 17.2 0.5 O B:HOH314 4.9 32.0 0.5 N B:SER73 4.9 11.6 1.0 OD2 B:ASP75 4.9 17.3 1.0 O B:SER72 4.9 14.3 1.0

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