Chlorine in PDB 8ilc: Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2

All present enzymatic activity of Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2:
3.4.19.12;

The structure of Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2, PDB code: 8ilc was solved by K.Wang, J.Nan, J.Lei, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	46.71 / 2.20
Space group	P 65
Cell size a, b, c (Å), α, β, γ (°)	108.014, 108.014, 53.909, 90, 90, 120
R / Rfree (%)	21.1 / 23.9

The binding sites of Chlorine atom in the Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2 (pdb code 8ilc). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2, PDB code: 8ilc:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2


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 Setmet Cov-Y Domain of NSP3 in Sars-Cov-2 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl2006 b:97.6 occ:1.00 O A:HOH2149 2.8 65.2 1.0 O A:HOH2150 3.0 78.9 1.0 OG A:SER1843 3.9 66.0 1.0 CB A:SER1843 3.9 67.7 1.0 NH2 A:ARG1912 3.9 62.5 1.0 CA A:SER1843 4.2 66.6 1.0 CG2 A:ILE1720 4.8 66.2 1.0 O A:GLN1842 4.8 62.7 1.0 NH1 A:ARG1912 4.9 66.8 1.0 CE A:LYS1909 4.9 81.3 1.0 CZ A:ARG1912 4.9 65.8 1.0 O A:SER1843 4.9 63.0 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl2007 b:98.2 occ:1.00 O A:HOH2132 3.7 65.3 1.0 OG1 A:THR1814 3.8 62.2 1.0 O A:HOH2137 4.3 64.3 1.0 CG2 A:THR1814 4.3 66.7 1.0 CB A:THR1814 4.4 56.5 1.0 CA A:THR1814 4.4 57.4 1.0 CB A:SER1817 4.9 67.9 1.0

K.Wang, J.Nan, J.Lei. Crystal Structure of Setmet Cov-Y Domain of NSP3 in Sars-Cov-2 To Be Published.