Chlorine in PDB 1ev3: Structure of the Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer

The structure of Structure of the Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer, PDB code: 1ev3 was solved by G.D.Smith, E.Ciszak, L.A.Magrum, W.A.Pangborn, R.H.Blessing, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	19.72 / 1.78
Space group	H 3
Cell size a, b, c (Å), α, β, γ (°)	78.866, 78.866, 39.465, 90.00, 90.00, 120.00
R / Rfree (%)	20 / 26.6

The structure of Structure of the Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer also contains other interesting chemical elements:

Zinc

(Zn)

2 atoms

The binding sites of Chlorine atom in the Structure of the Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer (pdb code 1ev3). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Structure of the Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer, PDB code: 1ev3:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Structure of the Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer


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 Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl32 b:20.1 occ:0.33 ZN B:ZN31 2.3 20.8 0.3 NE2 B:HIS10 3.4 20.9 1.0 CD2 B:HIS10 3.8 18.2 1.0 CB B:LEU6 3.8 23.4 1.0 CD1 B:LEU6 4.2 25.2 1.0 CG B:LEU6 4.4 24.6 1.0 CE1 B:HIS10 4.5 21.1 1.0 CD2 B:LEU6 4.6 25.6 1.0 O B:LEU6 4.8 21.8 1.0 CA B:LEU6 4.8 21.2 1.0 C B:LEU6 4.9 22.1 1.0

Chlorine binding site 2 out of 2 in the Structure of the Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of the Rhombohedral Form of the M-Cresol/Insulin R6 Hexamer within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl32 b:22.1 occ:0.33 ZN D:ZN31 2.4 21.5 0.3 NE2 D:HIS10 3.5 14.5 1.0 CB D:LEU6 3.8 20.5 1.0 CD2 D:HIS10 3.9 16.8 1.0 CD1 D:LEU6 4.1 23.1 1.0 CG D:LEU6 4.5 24.0 1.0 O D:LEU6 4.7 20.4 1.0 CE1 D:HIS10 4.7 20.6 1.0 CA D:LEU6 4.7 19.5 1.0 C D:LEU6 4.8 21.2 1.0 CD2 D:LEU6 4.9 24.4 1.0

G.D.Smith, E.Ciszak, L.A.Magrum, W.A.Pangborn, R.H.Blessing. R6 Hexameric Insulin Complexed with M-Cresol or Resorcinol. Acta Crystallogr.,Sect.D V. 56 1541 2000.
ISSN: ISSN 0907-4449
PubMed: 11092919
DOI: 10.1107/S0907444900012749