Chlorine in PDB 1exv: Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700

All present enzymatic activity of Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700:
2.4.1.1;

The structure of Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700, PDB code: 1exv was solved by V.L.Rath, M.Ammirati, D.E.Danley, J.L.Ekstrom, T.R.Hynes, T.V.Olson, D.J.Hoover, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	99.00 / 2.40
Space group	P 31
Cell size a, b, c (Å), α, β, γ (°)	124.629, 124.629, 124.064, 90.00, 90.00, 120.00
R / Rfree (%)	23.6 / 28

The binding sites of Chlorine atom in the Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700 (pdb code 1exv). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700, PDB code: 1exv:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl862 b:3.2 occ:1.00 CL1 A:700862 0.0 3.2 1.0 C4 A:700862 1.7 10.8 1.0 C3 A:700862 2.7 13.1 1.0 C5 A:700862 2.7 14.5 1.0 O A:ARG60 3.4 24.8 1.0 CB A:LEU63 3.5 19.3 1.0 CG A:ARG60 3.7 25.9 1.0 CE3 A:TRP67 3.8 17.3 1.0 CG2 A:VAL64 3.8 17.6 1.0 N A:VAL64 3.9 18.8 1.0 C6 A:700862 4.0 13.1 1.0 C2 A:700862 4.1 17.9 1.0 CZ3 A:TRP67 4.1 24.8 1.0 C A:LEU63 4.1 25.1 1.0 CD1 A:LEU63 4.2 15.8 1.0 CA A:VAL64 4.3 26.5 1.0 O A:HOH2133 4.3 22.0 1.0 C A:ARG60 4.3 22.3 1.0 CA A:LEU63 4.4 20.1 1.0 CG A:PRO229 4.5 13.7 1.0 CD A:ARG60 4.5 27.1 1.0 CG A:LEU63 4.5 21.2 1.0 C1 A:700862 4.6 14.7 1.0 O A:LEU63 4.7 29.7 1.0 CB A:VAL64 4.7 23.0 1.0 CB A:PRO229 4.8 24.8 1.0 CB A:ARG60 4.8 23.6 1.0 CA A:ARG60 4.8 23.1 1.0 CD2 A:TRP67 4.8 21.4 1.0 N A:LEU63 4.9 17.5 1.0

Chlorine binding site 2 out of 2 in the Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Human Liver Glycogen Phosphorylase A Complexed with Glcnac and Cp-403, 700 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl1862 b:2.6 occ:1.00 CL1 B:7001862 0.0 2.6 1.0 C4 B:7001862 1.7 21.5 1.0 C5 B:7001862 2.7 20.2 1.0 C3 B:7001862 2.7 23.7 1.0 O B:ARG60 3.4 21.6 1.0 CB B:LEU63 3.6 30.8 1.0 CE3 B:TRP67 3.7 24.2 1.0 CG B:ARG60 3.8 29.5 1.0 CG2 B:VAL64 3.8 22.7 1.0 N B:VAL64 3.9 26.4 1.0 CZ3 B:TRP67 4.0 20.1 1.0 C6 B:7001862 4.0 20.7 1.0 C2 B:7001862 4.1 17.5 1.0 C B:LEU63 4.2 28.6 1.0 CA B:VAL64 4.2 28.1 1.0 CD1 B:LEU63 4.3 25.5 1.0 O B:HOH2022 4.4 16.8 1.0 C B:ARG60 4.4 24.1 1.0 CA B:LEU63 4.4 31.2 1.0 CG B:PRO229 4.5 25.0 1.0 CD B:ARG60 4.6 28.2 1.0 C1 B:7001862 4.6 15.9 1.0 CG B:LEU63 4.6 30.5 1.0 CB B:VAL64 4.7 27.5 1.0 O B:LEU63 4.7 31.3 1.0 CD2 B:TRP67 4.8 26.9 1.0 CB B:PRO229 4.8 16.4 1.0 CB B:ARG60 4.9 20.3 1.0 CA B:ARG60 4.9 21.9 1.0 N B:LEU63 4.9 30.8 1.0

V.L.Rath, M.Ammirati, D.E.Danley, J.L.Ekstrom, E.M.Gibbs, T.R.Hynes, A.M.Mathiowetz, R.K.Mcpherson, T.V.Olson, J.L.Treadway, D.J.Hoover. Human Liver Glycogen Phosphorylase Inhibitors Bind at A New Allosteric Site. Chem.Biol. V. 7 677 2000.
ISSN: ISSN 1074-5521
PubMed: 10980448
DOI: 10.1016/S1074-5521(00)00004-1