Chlorine in PDB 3lxq: The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A

The structure of The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A, PDB code: 3lxq was solved by A.J.Stein, A.Weger, E.Duggan, S.Clancy, A.Joachimiak, Midwest Center Forstructural Genomics (Mcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	40.99 / 1.95
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	49.603, 164.521, 50.929, 90.00, 109.34, 90.00
R / Rfree (%)	19.8 / 23.7

The binding sites of Chlorine atom in the The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A (pdb code 3lxq). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A, PDB code: 3lxq:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1 b:26.7 occ:1.00 O A:HOH182 3.3 31.7 1.0 N A:THR330 3.4 27.4 1.0 N A:ARG331 3.5 26.5 1.0 CD A:ARG334 3.6 23.8 1.0 NH1 A:ARG334 3.6 23.3 1.0 CB A:ARG334 3.7 24.6 1.0 CB A:ARG331 3.7 28.4 1.0 OG1 A:THR330 3.8 30.9 1.0 CD A:ARG331 3.8 35.4 1.0 CG A:ARG331 3.8 30.5 1.0 NH1 A:ARG331 3.9 40.9 1.0 CA A:GLY329 3.9 25.5 1.0 CG A:ARG334 4.1 24.3 1.0 C A:GLY329 4.2 26.7 1.0 CA A:ARG331 4.2 27.4 1.0 CA A:THR330 4.2 27.8 1.0 C A:THR330 4.3 27.8 1.0 NE A:ARG334 4.3 23.1 1.0 CZ A:ARG334 4.4 23.8 1.0 CB A:THR330 4.6 29.9 1.0 O A:ARG331 4.8 24.5 1.0 NE A:ARG331 4.8 39.4 1.0 CZ A:ARG331 4.8 41.6 1.0 O A:GLN580 4.9 31.2 1.0 C A:ARG331 5.0 26.3 1.0

Chlorine binding site 2 out of 2 in the The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl2 b:24.7 occ:1.00 O B:HOH60 3.1 24.9 1.0 N B:THR330 3.3 21.0 1.0 N B:ARG331 3.6 21.1 1.0 NH1 B:ARG334 3.7 22.5 1.0 NH1 B:ARG331 3.7 40.9 1.0 CD B:ARG334 3.7 18.6 1.0 CB B:ARG331 3.7 22.5 1.0 OG1 B:THR330 3.8 25.3 1.0 CB B:ARG334 3.9 20.1 1.0 CD B:ARG331 3.9 32.3 1.0 CG B:ARG331 3.9 26.2 1.0 CA B:GLY329 4.0 18.9 1.0 C B:GLY329 4.2 18.9 1.0 CA B:THR330 4.3 21.2 1.0 CA B:ARG331 4.3 22.0 1.0 CG B:ARG334 4.3 19.1 1.0 C B:THR330 4.4 22.0 1.0 NE B:ARG334 4.5 19.9 1.0 CZ B:ARG334 4.5 21.1 1.0 CB B:THR330 4.6 23.8 1.0 CZ B:ARG331 4.7 40.3 1.0 O B:GLN580 4.7 21.5 1.0 NE B:ARG331 4.7 38.1 1.0 O B:ARG331 4.8 20.9 1.0

A.J.Stein, A.Weger, E.Duggan, S.Clancy, A.Joachimiak. The Crystal Structure of A Protein in the Alkaline Phosphatase Superfamily From Vibrio Parahaemolyticus to 1.95A To Be Published.