Chlorine in PDB 2q14: Crystal Structure of Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 A Resolution

The structure of Crystal Structure of Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 A Resolution, PDB code: 2q14 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)	49.03 / 2.20
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	115.436, 137.504, 279.051, 90.00, 90.00, 90.00
R / Rfree (%)	20.7 / 25.2

The binding sites of Chlorine atom in the Crystal Structure of Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 A Resolution (pdb code 2q14). 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 Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 A Resolution, PDB code: 2q14:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Crystal Structure of Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 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 Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl410 b:28.3 occ:1.00 O A:HOH506 3.0 15.5 1.0 N D:GLU178 3.1 30.9 1.0 OG A:SER206 3.3 25.1 1.0 CB D:THR177 3.6 31.4 1.0 CA A:GLY182 3.6 24.7 1.0 CA D:THR177 3.7 30.9 1.0 N A:GLY182 3.7 23.2 1.0 CB D:GLU178 3.7 32.0 1.0 CG D:GLU178 3.8 34.0 1.0 C D:THR177 3.9 32.4 1.0 CD A:ARG185 3.9 34.6 1.0 CA D:GLU178 4.0 31.0 1.0 CA A:SER206 4.0 26.0 1.0 CB A:SER206 4.0 26.0 1.0 O D:HOH549 4.1 34.4 1.0 NH1 A:ARG185 4.4 35.9 1.0 OG1 D:THR177 4.4 25.5 1.0 OD1 A:ASN209 4.5 30.3 1.0 NE A:ARG185 4.5 36.4 1.0 CG2 D:THR177 4.7 30.3 1.0 O A:SER206 4.8 24.0 1.0 CB A:ARG185 4.8 26.3 1.0 C A:GLY182 4.8 24.9 1.0 CZ A:ARG185 4.8 34.1 1.0 C D:GLU178 4.8 29.4 1.0 C A:ILE181 4.8 21.8 1.0 N A:SER206 4.8 24.9 1.0 O A:GLY182 4.8 22.7 1.0 CG A:ARG185 4.9 32.5 1.0 CD D:GLU178 4.9 41.4 1.0 C A:SER206 4.9 24.4 1.0 N D:GLY179 5.0 26.6 1.0 CB A:ASN209 5.0 21.9 1.0

Chlorine binding site 2 out of 3 in the Crystal Structure of Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 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 Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl410 b:72.1 occ:1.00 O C:HOH607 3.7 39.1 1.0 CD1 C:LEU223 4.3 30.4 1.0 CG2 C:VAL228 4.6 22.0 1.0 OE2 C:GLU231 4.6 49.0 1.0 CG1 C:VAL228 4.6 19.5 1.0 CB C:PRO355 4.7 38.4 1.0 OE1 C:GLU231 4.8 52.6 1.0 CD C:GLU231 5.0 37.0 1.0

Chlorine binding site 3 out of 3 in the Crystal Structure of Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 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 Phosphohydrolase (BT4208) From Bacteroides Thetaiotaomicron Vpi-5482 at 2.20 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl410 b:59.7 occ:1.00 OG D:SER83 3.6 40.3 1.0 CB D:PHE81 3.7 36.9 1.0 CG D:PHE81 3.8 39.3 1.0 OH D:TYR146 4.0 32.2 1.0 CD1 D:PHE81 4.1 42.0 1.0 CD D:GLU84 4.1 32.7 1.0 CG D:GLU84 4.1 32.6 1.0 OE2 D:GLU84 4.2 37.4 1.0 CD2 D:PHE81 4.4 40.3 1.0 OE1 D:GLU84 4.6 37.7 1.0 CE1 D:PHE81 4.8 41.7 1.0

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