Chlorine in PDB 6fj1: Structure of the Ldtfm-Avibactam Carbamoyl Enzyme

The structure of Structure of the Ldtfm-Avibactam Carbamoyl Enzyme, PDB code: 6fj1 was solved by I.Li De La Sierra Gallay, L.Iannazzo, F.Compain, M.Fonvielle, H.Vantilbeurgh, Z.Edoo, M.Arthur, M.Etheve-Quelquejeu, J.Hugonnet, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.04 / 2.69
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	208.540, 131.970, 70.090, 90.00, 90.14, 90.00
R / Rfree (%)	19.7 / 22.8

The binding sites of Chlorine atom in the Structure of the Ldtfm-Avibactam Carbamoyl Enzyme (pdb code 6fj1). 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 Structure of the Ldtfm-Avibactam Carbamoyl Enzyme, PDB code: 6fj1:

Chlorine binding site 1 out of 1 in the Structure of the Ldtfm-Avibactam Carbamoyl Enzyme


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of the Ldtfm-Avibactam Carbamoyl Enzyme within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl505 b:0.8 occ:1.00 O5 C:P3G502 3.5 0.0 1.0 CD2 A:TRP415 3.9 87.0 1.0 C7 C:P3G502 4.0 91.6 1.0 CE2 A:TRP415 4.0 84.4 1.0 C9 C:P3G502 4.0 0.5 1.0 CE3 A:TRP415 4.2 87.6 1.0 CG A:TRP415 4.2 81.0 1.0 C10 C:P3G502 4.3 0.4 1.0 NZ C:LYS277 4.3 0.1 1.0 C11 C:P3G502 4.3 0.4 1.0 CE C:LYS277 4.4 0.5 1.0 NE1 A:TRP415 4.4 82.9 1.0 CZ2 A:TRP415 4.4 85.2 1.0 CD1 A:TRP415 4.5 78.5 1.0 CZ3 A:TRP415 4.5 87.3 1.0 C12 C:P3G502 4.6 0.1 1.0 CH2 A:TRP415 4.6 93.8 1.0 O4 C:P3G502 4.9 0.8 1.0 CB A:TRP415 4.9 82.5 1.0 C8 C:P3G502 4.9 90.3 1.0 O3 C:P3G502 4.9 94.8 1.0

Z.Edoo, L.Iannazzo, F.Compain, H.Van Tilbeurgh, I.Li De La Sierra Gallay, M.Fonvielle, M.Arthur, M.Etheve-Quelquejeu, J.Hugonnet. Avibactam Derivatives with Dual Activities in the Inhibition of Beta-Lactamases and L,D-Transpeptidases From Mycobacteria To Be Published.