Chlorine in PDB 8sc9: Structure of Pparg in Complex with Mtx-531

The structure of Structure of Pparg in Complex with Mtx-531, PDB code: 8sc9 was solved by C.E.Whitehead, J.Leopold, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	33.22 / 1.86
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	93.205, 61.383, 118.741, 90, 102.52, 90
R / Rfree (%)	21.2 / 24.1

The binding sites of Chlorine atom in the Structure of Pparg in Complex with Mtx-531 (pdb code 8sc9). 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 Pparg in Complex with Mtx-531, PDB code: 8sc9:

Chlorine binding site 1 out of 1 in the Structure of Pparg in Complex with Mtx-531


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of Pparg in Complex with Mtx-531 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl1006 b:68.0 occ:1.00 CL B:D0D1006 0.0 68.0 1.0 C8 B:D0D1006 1.7 69.1 1.0 N B:D0D1006 2.6 69.0 1.0 HG3 B:MET329 2.6 34.0 0.0 C9 B:D0D1006 2.7 70.2 1.0 N1 B:D0D1006 3.0 71.0 1.0 HB1 B:ALA292 3.0 39.7 0.0 SD B:MET329 3.1 55.2 0.8 HB2 B:MET329 3.3 40.4 0.0 HE1 B:PHE226 3.4 38.7 0.0 HB2 B:MET329 3.4 35.2 0.0 HD1 B:PHE226 3.4 39.0 0.0 HB3 B:MET329 3.5 35.5 0.0 HD11 B:ILE296 3.5 34.5 0.0 HB3 B:MET329 3.6 40.7 0.0 CG B:MET329 3.6 34.3 0.2 CB B:MET329 3.7 35.6 0.2 HG13 B:ILE296 3.7 34.2 0.0 HE3 B:MET329 3.7 25.9 0.0 CB B:MET329 3.8 40.8 0.8 HE2 B:MET329 3.8 25.7 0.0 CE1 B:PHE226 3.8 38.3 1.0 CD1 B:PHE226 3.8 38.0 1.0 HB2 B:ALA292 3.8 40.1 0.0 C7 B:D0D1006 3.8 69.2 1.0 CB B:ALA292 3.9 39.5 1.0 O B:D0D1006 3.9 71.7 1.0 OE1 B:GLU295 3.9 42.2 1.0 CG B:MET329 3.9 44.6 0.8 HE2 B:MET329 4.0 52.5 0.0 C10 B:D0D1006 4.0 70.2 1.0 HA B:ALA292 4.0 40.8 0.0 CE B:MET329 4.0 52.2 0.8 S B:D0D1006 4.1 71.7 1.0 HA B:ILE326 4.1 33.8 0.0 HE1 B:MET329 4.2 52.7 0.0 HG2 B:MET329 4.2 33.7 0.0 CE B:MET329 4.2 25.5 0.2 HG22 B:ILE325 4.2 33.7 0.0 HG3 B:MET329 4.3 44.1 0.0 HG12 B:ILE296 4.3 33.8 0.0 HB2 B:GLU295 4.4 38.3 0.0 CG1 B:ILE296 4.4 34.1 1.0 CD1 B:ILE296 4.4 34.9 1.0 C6 B:D0D1006 4.4 69.8 1.0 CA B:ALA292 4.5 39.8 1.0 C11 B:D0D1006 4.6 71.1 1.0 HG12 B:ILE326 4.6 35.0 0.0 HB3 B:ALA292 4.7 39.9 0.0 SD B:MET329 4.8 26.6 0.2 O B:ALA292 4.8 38.7 1.0 HD12 B:ILE296 4.8 34.7 0.0 CZ B:PHE226 4.8 38.6 1.0 CG B:PHE226 4.9 39.0 1.0 HG2 B:MET329 4.9 44.3 0.0 HB3 B:PHE226 4.9 41.3 0.0

C.E.Whitehead, J.Leopold. Structure of Pparg in Complex with Mtx-531 To Be Published.