Chlorine in PDB 7x1o: Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95

All present enzymatic activity of Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95:
6.1.1.15; 6.1.1.17;

The structure of Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95, PDB code: 7x1o was solved by Y.Manickam, P.Babbar, A.Sharma, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	33.52 / 2.04
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	72.03, 93.73, 87.09, 90, 109.62, 90
R / Rfree (%)	19.4 / 23.7

The structure of Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95 also contains other interesting chemical elements:

Zinc	(Zn)	5 atoms
Bromine	(Br)	4 atoms
Calcium	(Ca)	4 atoms

The binding sites of Chlorine atom in the Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95 (pdb code 7x1o). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95, PDB code: 7x1o:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1901 b:61.5 occ:1.00 CL1 A:HFG1901 0.0 61.5 1.0 C6 A:HFG1901 1.7 60.2 1.0 C5 A:HFG1901 2.7 46.4 1.0 C7 A:HFG1901 2.7 83.5 1.0 BR1 A:HFG1901 3.3 92.6 1.0 CG A:PRO1120 3.5 54.8 1.0 O A:HOH2069 3.7 69.3 1.0 C10 A:HFG1901 4.0 55.4 1.0 C8 A:HFG1901 4.0 70.2 1.0 O A:HOH2074 4.2 50.7 1.0 CB A:PRO1120 4.4 46.5 1.0 C9 A:HFG1901 4.5 59.6 1.0 CD1 A:LEU1087 4.6 58.3 1.0 CD A:PRO1120 4.7 34.2 1.0 O A:HOH2076 4.9 65.1 1.0 CB A:PRO1099 4.9 72.5 1.0

Chlorine binding site 2 out of 2 in the Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Homo Sapiens Prolyl-Trna Synthetase (Hsprs) in Complex with Double Inhibitors Hf and L95 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl1901 b:54.7 occ:1.00 CL1 B:HFG1901 0.0 54.7 1.0 C6 B:HFG1901 1.7 50.6 1.0 C5 B:HFG1901 2.7 47.9 1.0 C7 B:HFG1901 2.7 59.3 1.0 BR1 B:HFG1901 3.3 86.2 1.0 CD2 B:HIS1093 3.4 58.7 1.0 NE2 B:HIS1093 3.4 59.7 1.0 CG B:PRO1120 3.5 44.1 1.0 CG2 B:VAL1101 3.6 53.0 1.0 CG B:HIS1093 3.8 55.2 1.0 CB B:PHE1097 3.8 63.0 1.0 CE1 B:HIS1093 3.8 59.5 1.0 C10 B:HFG1901 4.0 49.4 1.0 C8 B:HFG1901 4.0 49.8 1.0 ND1 B:HIS1093 4.0 57.0 1.0 CB B:PRO1120 4.4 40.5 1.0 CG B:PHE1097 4.4 59.5 1.0 C9 B:HFG1901 4.5 49.8 1.0 O B:PHE1097 4.6 59.9 1.0 CB B:HIS1093 4.6 51.4 1.0 CD B:PRO1120 4.7 44.5 1.0 CD2 B:PHE1097 4.7 58.1 1.0 CD1 B:LEU1087 4.8 50.7 1.0 C B:PHE1097 4.8 65.5 1.0 O B:HOH2058 4.8 54.7 1.0 CA B:PHE1097 5.0 66.9 1.0

Y.Manickam, P.Babbar, A.Sharma. Crystal Structure of Homo Sapiens Prolyl-Trna Synthetase (Hsprs) with Double Inhibitors (Hf and L95) To Be Published.