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Chlorine in PDB 8w0l: Crystal Structure of Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor and Coa

Protein crystallography data

The structure of Crystal Structure of Acetyl-Coa Synthetase 2 From Candida Albicans in Complex with A Propyne Amp Ester Inhibitor and Coa, PDB code: 8w0l 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) 48.62 / 2.75
Space group P 61 2 2
Cell size a, b, c (Å), α, β, γ (°) 139.179, 139.179, 543.69, 90, 90, 120
R / Rfree (%) 20.3 / 23.9

Chlorine Binding Sites:

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 and Coa (pdb code 8w0l). 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 and Coa, PDB code: 8w0l:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in 8w0l

Go back to Chlorine Binding Sites List in 8w0l
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 and Coa


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 and Coa within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl704

b:121.3
occ:1.00
NH2 B:ARG618 3.3 114.5 1.0
CZ B:ARG618 4.7 116.1 1.0

Chlorine binding site 2 out of 2 in 8w0l

Go back to Chlorine Binding Sites List in 8w0l
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 and Coa


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 and Coa within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Cl705

b:103.9
occ:1.00
N B:THR300 3.3 95.9 1.0
NZ B:LYS515 3.4 117.2 1.0
CE B:LYS651 3.8 160.2 1.0
NZ B:LYS651 4.0 151.8 1.0
OG1 B:THR300 4.2 103.8 1.0
O B:THR300 4.4 95.7 1.0
CA B:THR300 4.5 101.9 1.0
CE B:LYS515 4.6 117.1 1.0
CG2 B:THR300 4.7 104.0 1.0
CB B:THR300 4.7 101.2 1.0
C B:THR300 5.0 98.1 1.0

Reference:

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 and Coa To Be Published.
Page generated: Sun Jul 13 15:27:27 2025

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