Chlorine in PDB 5jkk: Crystal Structure of the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin

All present enzymatic activity of Crystal Structure of the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin:
1.16.3.1;

The structure of Crystal Structure of the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin, PDB code: 5jkk was solved by M.Kuenzle, T.Beck, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.37 / 1.60
Space group	P 2 3
Cell size a, b, c (Å), α, β, γ (°)	180.980, 180.980, 180.980, 90.00, 90.00, 90.00
R / Rfree (%)	12.4 / 14.3

The structure of Crystal Structure of the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin also contains other interesting chemical elements:

Magnesium	(Mg)	17 atoms
Iron	(Fe)	10 atoms

The binding sites of Chlorine atom in the Crystal Structure of the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin (pdb code 5jkk). 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 the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin, PDB code: 5jkk:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin


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 the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl205 b:9.7 occ:1.00 FE A:FE202 2.5 27.4 0.5 NE2 F:HIS173 3.1 10.9 1.0 NE2 G:HIS173 3.2 12.5 1.0 NE2 C:HIS173 3.2 11.8 1.0 NE2 A:HIS173 3.2 12.3 1.0 CD2 A:LEU169 3.9 9.2 1.0 CD2 C:LEU169 3.9 8.5 1.0 CD2 F:LEU169 3.9 8.9 1.0 CD2 G:LEU169 4.0 8.5 1.0 CE1 C:HIS173 4.0 12.7 1.0 CE1 G:HIS173 4.0 12.1 1.0 CE1 F:HIS173 4.0 13.0 1.0 CD2 A:HIS173 4.1 12.7 1.0 CD2 F:HIS173 4.1 12.1 1.0 CD2 G:HIS173 4.1 11.8 1.0 CE1 A:HIS173 4.1 12.0 1.0 CD2 C:HIS173 4.1 12.2 1.0 CD1 G:LEU169 4.8 10.5 1.0 CD1 F:LEU169 4.8 9.3 1.0 CD1 A:LEU169 4.8 9.5 1.0 CD1 C:LEU169 4.9 10.1 1.0 CG A:LEU169 4.9 8.4 1.0 CG F:LEU169 4.9 8.4 1.0 CG C:LEU169 5.0 8.1 1.0 CG G:LEU169 5.0 9.0 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin


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 the Negatively Supercharged Variant Ftn(Neg) of Human Heavy Chain Ferritin within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl205 b:2.0 occ:0.25 FE D:FE202 2.6 12.1 0.2 NE2 D:HIS173 3.1 12.9 1.0 NE2 E:HIS173 3.1 12.6 1.0 CD2 D:LEU169 3.9 8.8 1.0 CD2 E:LEU169 3.9 8.8 1.0 CE1 D:HIS173 4.1 13.6 1.0 CD2 D:HIS173 4.1 11.2 1.0 CD2 E:HIS173 4.1 11.7 1.0 CE1 E:HIS173 4.1 12.7 1.0 CD1 E:LEU169 4.8 10.6 1.0 CD1 D:LEU169 4.8 10.4 1.0 CG D:LEU169 4.9 8.9 1.0 CG E:LEU169 5.0 9.3 1.0

M.Kuenzle, T.Eckert, T.Beck. Self-Assembly of Charged Protein Containers Enables Positioning of Nanoparticles in A 3-D Lattice to Form Biohybrid Materials To Be Published.