Chlorine in PDB 3kyz: The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01

All present enzymatic activity of The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01:
2.7.13.3;

The structure of The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01, PDB code: 3kyz was solved by K.Tan, N.Marshall, K.Buck, 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)	35.00 / 1.50
Space group	I 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	29.920, 95.468, 103.565, 90.00, 90.00, 90.00
R / Rfree (%)	15.1 / 18.1

The binding sites of Chlorine atom in the The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01 (pdb code 3kyz). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01, PDB code: 3kyz:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01


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 the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1 b:20.6 occ:0.80 O A:HOH261 3.0 47.8 1.0 O A:HOH21 3.1 17.1 1.0 N A:GLU128 3.2 12.5 1.0 O A:HOH9 3.3 17.4 1.0 CG A:GLU128 3.6 19.9 1.0 CB A:GLU128 3.7 16.5 1.0 O A:SER126 3.9 11.9 1.0 CA A:ILE127 3.9 11.6 1.0 C A:ILE127 4.0 11.1 1.0 CD A:GLU128 4.1 24.6 1.0 CA A:GLU128 4.1 14.2 1.0 OE1 A:GLU128 4.3 28.2 1.0 CD A:LYS109 4.3 18.9 1.0 CE A:LYS109 4.5 22.5 1.0 CG A:LYS109 4.5 16.1 1.0 C A:SER126 4.6 10.6 1.0 N A:ILE127 4.6 10.6 1.0 O A:HOH169 4.6 30.3 1.0 OE2 A:GLU128 4.8 27.2 1.0 CG2 A:ILE127 4.8 13.7 1.0 O A:HOH265 4.9 45.0 1.0 NZ A:LYS109 5.0 26.7 1.0 CB A:ILE127 5.0 12.2 1.0

Chlorine binding site 2 out of 3 in the The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01


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 the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl2 b:19.9 occ:1.00 O A:HOH205 3.1 23.6 1.0 N A:HIS87 3.2 11.5 1.0 N A:GLU89 3.3 12.1 1.0 CA A:GLY85 3.4 10.5 1.0 O A:HOH218 3.4 35.6 1.0 C A:GLY85 3.4 10.1 1.0 CB A:GLU89 3.5 17.4 1.0 N A:PRO86 3.6 11.8 1.0 CB A:HIS87 3.7 17.0 1.0 O A:GLU89 3.7 12.0 1.0 CA A:HIS87 3.7 12.7 1.0 N A:GLY85 3.7 10.8 1.0 N A:LEU88 3.7 10.3 1.0 CD A:PRO86 3.8 13.8 1.0 CA A:GLU89 3.8 12.8 1.0 C A:HIS87 3.8 11.5 1.0 O A:GLY85 3.9 11.7 1.0 CD2 A:HIS87 4.1 26.9 1.0 C A:GLU89 4.1 11.1 1.0 CG A:HIS87 4.2 23.8 1.0 CG A:GLU89 4.2 24.1 1.0 C A:PRO86 4.3 11.7 1.0 C A:LEU88 4.4 12.7 1.0 CA A:PRO86 4.5 13.5 1.0 CA A:LEU88 4.6 10.2 1.0 O A:HIS87 4.6 14.0 1.0 CD A:GLU89 4.8 35.4 1.0 O A:HOH277 4.8 46.5 1.0 OE2 A:GLU89 4.9 40.5 1.0 CG A:PRO86 4.9 17.7 1.0

Chlorine binding site 3 out of 3 in the The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl3 b:18.2 occ:0.70 O A:HOH242 2.7 33.6 1.0 O A:HOH173 2.8 25.0 1.0 N A:SER90 3.0 10.8 1.0 N A:LEU96 3.0 13.3 1.0 O A:HOH174 3.5 32.8 1.0 CA A:PRO95 3.6 14.8 1.0 CA A:GLU89 3.7 12.8 1.0 CB A:SER90 3.7 13.7 1.0 CB A:GLU89 3.7 17.4 1.0 C A:PRO95 3.8 13.0 1.0 C A:GLU89 3.8 11.1 1.0 CB A:LEU96 3.8 13.1 1.0 CB A:PRO95 3.8 16.9 1.0 CG A:LEU96 3.9 14.7 1.0 CA A:SER90 3.9 11.5 1.0 CA A:LEU96 4.0 13.1 1.0 CG A:GLU89 4.2 24.1 1.0 O A:LEU96 4.4 14.4 1.0 OE1 A:GLU89 4.5 38.9 1.0 CD1 A:LEU96 4.6 18.5 1.0 C A:LEU96 4.7 12.6 1.0 O A:SER90 4.7 12.3 1.0 O A:HOH167 4.9 27.6 1.0 C A:SER90 4.9 10.5 1.0 CD A:GLU89 4.9 35.4 1.0 N A:PRO95 5.0 15.5 1.0 O A:GLU89 5.0 12.0 1.0

K.Tan, N.Marshall, K.Buck, A.Joachimiak. The Crystal Structure of the Sensor Domain of Two-Component Sensor Pfes From Pseudomonas Aeruginosa PA01 To Be Published.