Chlorine in PDB 6s9a: Artificial Gtpase-Bse Dimer of Human DYNAMIN1

All present enzymatic activity of Artificial Gtpase-Bse Dimer of Human DYNAMIN1:
3.6.5.5;

The structure of Artificial Gtpase-Bse Dimer of Human DYNAMIN1, PDB code: 6s9a was solved by O.M.Ganichkin, R.Vancraenenbroeck, G.Rosenblum, H.Hofmann, O.Daumke, J.K.Noel, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.73 / 1.86
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	70.693, 69.546, 74.277, 90.00, 113.15, 90.00
R / Rfree (%)	21.9 / 25.5

The structure of Artificial Gtpase-Bse Dimer of Human DYNAMIN1 also contains other interesting chemical elements:

Zinc

(Zn)

4 atoms

The binding sites of Chlorine atom in the Artificial Gtpase-Bse Dimer of Human DYNAMIN1 (pdb code 6s9a). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Artificial Gtpase-Bse Dimer of Human DYNAMIN1, PDB code: 6s9a:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Artificial Gtpase-Bse Dimer of Human DYNAMIN1


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Artificial Gtpase-Bse Dimer of Human DYNAMIN1 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl803 b:45.5 occ:1.00 O A:HOH930 2.9 40.3 1.0 O A:HOH955 3.0 44.8 1.0 O A:HOH921 3.2 44.4 1.0 N A:ASP185 3.4 35.0 1.0 CE1 B:HIS183 3.7 46.1 1.0 CA A:SER184 3.8 36.1 1.0 OD2 A:ASP185 3.8 43.2 1.0 CD A:PRO176 3.8 42.9 1.0 O A:HIS183 4.0 42.8 1.0 C A:SER184 4.1 36.8 1.0 CA A:GLY39 4.1 40.6 1.0 N A:GLY39 4.2 37.2 1.0 CG A:ASP185 4.2 39.6 1.0 CB A:ALA42 4.2 44.3 1.0 CB A:ASP185 4.2 39.7 1.0 CG A:PRO176 4.4 46.5 1.0 CA A:ASP185 4.4 37.8 1.0 OG A:SER184 4.5 36.4 1.0 ND1 B:HIS183 4.5 42.5 1.0 O B:HOH933 4.5 62.4 1.0 CB A:SER184 4.6 36.7 1.0 NE2 B:HIS183 4.6 45.2 1.0 N A:SER184 4.6 37.0 1.0 C A:HIS183 4.7 37.6 1.0 CA A:ALA42 4.8 47.3 1.0 O B:HOH952 4.8 42.9 1.0 ZN A:ZN801 4.9 45.7 1.0 O A:HOH943 4.9 41.7 1.0 C A:GLY39 4.9 45.2 1.0 N A:ALA42 5.0 48.8 1.0

Chlorine binding site 2 out of 2 in the Artificial Gtpase-Bse Dimer of Human DYNAMIN1


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Artificial Gtpase-Bse Dimer of Human DYNAMIN1 within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl803 b:42.6 occ:1.00 O B:HOH924 2.9 34.5 1.0 O B:HOH1007 3.0 41.0 1.0 O B:HOH990 3.1 40.8 1.0 N B:ASP185 3.4 32.0 1.0 CE1 A:HIS183 3.7 41.1 1.0 CA B:SER184 3.8 37.7 1.0 OD2 B:ASP185 3.8 38.4 1.0 CD B:PRO176 3.9 36.9 1.0 CA B:GLY39 4.0 37.0 1.0 N B:GLY39 4.1 33.3 1.0 CB B:ALA42 4.1 37.9 1.0 O B:HIS183 4.1 37.3 1.0 C B:SER184 4.1 32.8 1.0 CG B:ASP185 4.2 34.9 1.0 CB B:ASP185 4.3 32.8 1.0 CG B:PRO176 4.4 39.6 1.0 CA B:ASP185 4.5 36.2 1.0 O A:HOH942 4.5 58.5 1.0 OG B:SER184 4.5 40.1 1.0 ND1 A:HIS183 4.5 41.0 1.0 CB B:SER184 4.6 38.8 1.0 NE2 A:HIS183 4.6 44.1 1.0 N B:SER184 4.6 38.5 1.0 CA B:ALA42 4.7 40.7 1.0 C B:HIS183 4.7 39.5 1.0 C B:GLY39 4.8 37.2 1.0 N B:ALA42 4.8 43.4 1.0 ZN B:ZN801 4.9 45.9 1.0 O A:HOH939 5.0 41.7 1.0

O.M.Ganichkin, R.Vancraenenbroeck, G.Rosenblum, H.Hofmann, O.Daumke, J.K.Noel. Gtpase-Bse Minimal Human DYNAMIN1 Construct To Be Published.