Chlorine in PDB 6pmc: Trk-A in Complex with Ligand 1A

All present enzymatic activity of Trk-A in Complex with Ligand 1A:
2.7.10.1;

The structure of Trk-A in Complex with Ligand 1A, PDB code: 6pmc was solved by G.Subramanian, D.G.Brown, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	45.64 / 2.19
Space group	P 31 1 2
Cell size a, b, c (Å), α, β, γ (°)	52.657, 52.657, 233.544, 90.00, 90.00, 120.00
R / Rfree (%)	24.6 / 29.8

The binding sites of Chlorine atom in the Trk-A in Complex with Ligand 1A (pdb code 6pmc). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Trk-A in Complex with Ligand 1A, PDB code: 6pmc:

Chlorine binding site 1 out of 1 in the Trk-A in Complex with Ligand 1A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Trk-A in Complex with Ligand 1A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl801 b:39.8 occ:1.00 CL1 A:OQJ801 0.0 39.8 1.0 C5 A:OQJ801 1.7 40.4 1.0 C6 A:OQJ801 2.7 41.0 1.0 C4 A:OQJ801 2.7 43.8 1.0 C7 A:OQJ801 4.0 42.0 1.0 C3 A:OQJ801 4.0 43.2 1.0 CA A:GLY667 4.2 36.8 1.0 C A:GLY667 4.2 35.6 1.0 CD1 A:LEU567 4.2 53.9 1.0 CG2 A:ILE572 4.3 30.5 1.0 O A:ILE666 4.4 31.7 1.0 CG2 A:ILE666 4.5 29.1 1.0 CD2 A:HIS648 4.5 29.5 1.0 C2 A:OQJ801 4.5 42.2 1.0 O A:GLY667 4.5 28.3 1.0 N A:ASP668 4.5 38.7 1.0 NE2 A:HIS648 4.6 28.6 1.0 CD1 A:LEU641 4.7 33.9 1.0 C A:ILE666 4.7 32.8 1.0 CD1 A:ILE572 4.7 35.1 1.0 N A:GLY667 4.8 32.9 1.0 CD2 A:LEU641 4.8 33.5 1.0 CB A:ASP668 4.8 46.2 1.0 O2 A:OQJ801 4.9 42.9 1.0

G.Subramanian, S.J.Bowen, Y.Zhu, N.Roush, T.Zachary, C.Javens, T.Williams, A.Janssen, A.Gonzales. Synthetic Inhibitor Leads of Human Tropomyosin Receptor Kinase A (Htrka) Rsc Med Chem 2020.
DOI: 10.1039/C9MD00554D