Chlorine in PDB 8cig: Crystal Structure of An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium.

The structure of Crystal Structure of An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium., PDB code: 8cig was solved by M.Liutkus, A.L.Rojas, A.L.Cortajarena, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	58.93 / 1.40
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	68.046, 68.046, 72.285, 90, 90, 120
R / Rfree (%)	16.9 / 19.2

The structure of Crystal Structure of An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium. also contains other interesting chemical elements:

Calcium

(Ca)

6 atoms

The binding sites of Chlorine atom in the Crystal Structure of An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium. (pdb code 8cig). 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 An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium., PDB code: 8cig:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium.


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 An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium. within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl312 b:63.2 occ:1.00 O A:HOH443 3.0 28.9 1.0 O A:HOH508 3.2 31.9 1.0 O A:HOH444 3.7 42.5 1.0 CG A:ASP52 3.8 19.0 1.0 CB A:ASP52 3.8 18.6 1.0 OD1 A:ASP52 4.0 19.9 1.0 OD2 A:ASP52 4.1 20.0 1.0 O A:HOH511 4.2 33.8 1.0 CA A:ASP52 4.5 18.7 1.0 OE2 A:GLU56 4.6 41.9 1.0 O A:ASP52 4.7 19.8 1.0 CA A:CA301 4.7 20.5 1.0 CA A:CA302 4.8 19.2 1.0 C A:ASP52 4.8 18.0 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium.


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 An 8-Repeat Consensus Tpr Superhelix in Tris Buffer with Calcium. within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl313 b:34.8 occ:0.50 O A:HOH450 2.7 33.8 1.0 O A:HOH448 3.5 20.9 1.0 O A:HOH447 3.6 26.3 1.0 O A:HOH526 4.0 42.9 1.0 CA A:CA303 4.3 19.2 1.0 CA A:CA302 4.5 19.2 1.0 OD2 A:ASP84 4.7 22.4 1.0 O A:HOH508 4.7 31.9 1.0 OD1 A:ASP84 5.0 23.1 1.0

M.Liutkus, A.L.Rojas, I.R.Sasselli, A.L.Cortajarena. Diverse Crystalline Protein Scaffolds Through Metal-Dependent Polymorphism. To Be Published.