Chlorine in PDB 8w0j: Crystal Structure of Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor

The structure of Crystal Structure of Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor, PDB code: 8w0j was solved by Seattle Structural Genomics Center For Infectious Disease, Seattlestructural Genomics Center For Infectious Disease (Ssgcid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	49.62 / 2.85
Space group	P 61 2 2
Cell size a, b, c (Å), α, β, γ (°)	139.073, 139.073, 544.504, 90, 90, 120
R / Rfree (%)	19.6 / 22.6

The binding sites of Chlorine atom in the Crystal Structure of Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor (pdb code 8w0j). 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 Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor, PDB code: 8w0j:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor


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 Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl705 b:96.0 occ:1.00 NH1 B:ARG618 3.2 124.7 1.0 NH2 B:ARG618 4.0 125.5 1.0 CZ B:ARG618 4.1 125.3 1.0 CG1 B:VAL614 4.3 131.1 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor


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 Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl706 b:87.4 occ:1.00 NZ B:LYS515 2.7 104.5 1.0 N B:THR300 3.6 135.0 1.0 CE B:LYS515 4.0 94.2 1.0 CA B:GLY299 4.1 136.0 1.0 CB B:THR300 4.3 120.1 1.0 CG2 B:THR300 4.4 112.0 1.0 C B:GLY299 4.4 137.7 1.0 CA B:THR300 4.5 128.3 1.0 O B:THR300 4.9 116.8 1.0

L.Liu, S.Lovell, K.P.Battaile. Crystal Structure of Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor To Be Published.