Chlorine in PDB 6xys: Update of Native Acetylcholinesterase From Drosophila Melanogaster

All present enzymatic activity of Update of Native Acetylcholinesterase From Drosophila Melanogaster:
3.1.1.7;

The structure of Update of Native Acetylcholinesterase From Drosophila Melanogaster, PDB code: 6xys was solved by F.Nachon, J.L.Sussman, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	34.18 / 2.46
Space group	P 43 21 2
Cell size a, b, c (Å), α, β, γ (°)	94.620, 94.620, 159.010, 90.00, 90.00, 90.00
R / Rfree (%)	22.9 / 29.6

The binding sites of Chlorine atom in the Update of Native Acetylcholinesterase From Drosophila Melanogaster (pdb code 6xys). 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 Update of Native Acetylcholinesterase From Drosophila Melanogaster, PDB code: 6xys:

Chlorine binding site 1 out of 1 in the Update of Native Acetylcholinesterase From Drosophila Melanogaster


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Update of Native Acetylcholinesterase From Drosophila Melanogaster within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl606 b:97.6 occ:0.50 NH2 A:ARG24 4.0 0.9 1.0 CZ A:ARG24 4.3 0.6 1.0 NH1 A:ARG24 4.4 0.1 1.0 NE A:ARG24 5.0 0.6 1.0

F.Nachon, T.L.Rosenberry, I.Silman, J.L.Sussman. A Second Look at the Crystal Structures Ofdrosophila Melanogasteracetylcholinesterase in Complex with Tacrine Derivatives Provides Insights Concerning Catalytic Intermediates and the Design of Specific Insecticides. Molecules V. 25 2020.
ISSN: ESSN 1420-3049
PubMed: 32155891
DOI: 10.3390/MOLECULES25051198