Chlorine in PDB 4fl5: Crystal Structure of Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214

The structure of Crystal Structure of Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214, PDB code: 4fl5 was solved by B.Schumacher, C.Ottmann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	19.64 / 1.90
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	62.690, 70.080, 128.130, 90.00, 90.00, 90.00
R / Rfree (%)	15.6 / 21.2

The structure of Crystal Structure of Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214 also contains other interesting chemical elements:

Magnesium	(Mg)	4 atoms
Calcium	(Ca)	6 atoms

The binding sites of Chlorine atom in the Crystal Structure of Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214 (pdb code 4fl5). 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 Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214, PDB code: 4fl5:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214


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 Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl301 b:67.9 occ:1.00 O A:THR136 2.7 32.2 1.0 N A:ASP139 2.9 32.1 1.0 O A:HOH663 3.0 45.2 1.0 N A:ASP138 3.1 35.8 1.0 CB A:ASP139 3.5 30.2 0.5 CB A:ASP139 3.6 30.3 0.5 C A:GLY137 3.6 35.8 1.0 CG A:ASP139 3.6 27.5 0.5 CA A:GLY137 3.8 34.2 1.0 C A:THR136 3.8 31.1 1.0 CA A:ASP139 3.8 29.7 0.5 CA A:ASP139 3.8 29.7 0.5 C A:ASP138 3.9 33.7 1.0 CA A:ASP138 3.9 35.1 1.0 N A:GLY137 4.2 32.4 1.0 CB A:ASP138 4.2 37.2 1.0 O A:GLY137 4.5 36.1 1.0 N A:LYS140 4.6 26.1 1.0 O A:HOH566 4.7 32.8 1.0 OG1 A:THR136 4.7 29.4 0.5 C A:ASP139 4.8 28.2 1.0 CG A:ASP139 4.9 28.4 0.5

Chlorine binding site 2 out of 2 in the Crystal Structure of Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214


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 Human 14-3-3 Sigma in Complex with A Tau-Protein Peptide Surrounding PS214 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:46.8 occ:1.00 O A:HOH562 3.6 27.1 1.0 OD A:CSO38 4.1 13.1 1.0 CB A:ASN42 4.2 11.6 1.0 O P:HOH407 4.3 35.6 1.0 CA A:GLU39 4.6 9.3 1.0 CG A:ASN42 4.6 16.9 1.0 OD1 A:ASN42 4.8 26.9 1.0 CG A:GLU39 4.9 14.7 1.0

Y.Joo, B.Schumacher, M.Bartel, C.Smet-Nocca, A.Jang, H.S.Choi, N.L.Jeon, H.S.Kim, I.Landrieu, Y.H.Suh, C.Ottmann. 14-3-3 Binding to Tau Causes Tubulin Instability and Impairs Axon Development: Structural Basis and Functional Consequences of 14-3-3/Tau Interaction To Be Published.