Chlorine in PDB 6bdv: Crystal Structure of Caspase 3 S150A

All present enzymatic activity of Crystal Structure of Caspase 3 S150A:
3.4.22.56;

The structure of Crystal Structure of Caspase 3 S150A, PDB code: 6bdv was solved by M.E.Thomas, R.Grinshpon, P.D.Swartz, A.C.Clark, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	35.59 / 1.94
Space group	I 2 2 2
Cell size a, b, c (Å), α, β, γ (°)	67.753, 84.405, 96.283, 90.00, 90.00, 90.00
R / Rfree (%)	15.9 / 19.6

The binding sites of Chlorine atom in the Crystal Structure of Caspase 3 S150A (pdb code 6bdv). 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 Crystal Structure of Caspase 3 S150A, PDB code: 6bdv:

Chlorine binding site 1 out of 1 in the Crystal Structure of Caspase 3 S150A


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 Caspase 3 S150A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl301 b:35.0 occ:1.00 N A:GLY66 2.9 26.7 1.0 NZ A:LYS53 3.0 40.5 1.0 N A:ASP68 3.3 23.5 1.0 CA A:GLY66 3.4 27.1 1.0 CB A:ASP68 3.4 26.2 1.0 CE A:LYS53 3.5 42.5 1.0 N A:THR67 3.5 23.8 1.0 C A:GLY66 3.6 29.4 1.0 CG A:ASP68 3.6 36.8 1.0 OD2 A:ASP68 3.7 35.7 1.0 CA A:ASP68 3.9 24.5 1.0 CD A:LYS53 4.0 25.4 1.0 C A:SER65 4.0 34.5 1.0 O A:HOH430 4.1 36.6 1.0 CA A:SER65 4.2 34.5 1.0 C A:THR67 4.3 20.6 1.0 OD1 A:ASP68 4.3 23.1 1.0 O A:GLY66 4.4 24.4 1.0 O A:ARG64 4.4 23.5 1.0 CA A:THR67 4.4 22.3 1.0 CG2 A:THR67 4.5 20.8 1.0 N A:VAL69 4.5 17.4 1.0 C A:ASP68 4.8 21.1 1.0 CG A:LYS53 4.8 27.7 1.0

M.E.Thomas, R.Grinshpon, P.Swartz, A.C.Clark. Modifications to A Common Phosphorylation Network Provide Individualized Control in Caspases. J. Biol. Chem. V. 293 5447 2018.
ISSN: ESSN 1083-351X
PubMed: 29414778
DOI: 10.1074/JBC.RA117.000728