Zinc in PDB 5f6q: Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames

The structure of Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames, PDB code: 5f6q was solved by N.Maltseva, Y.Kim, J.Osipiuk, W.F.Anderson, A.Joachimiak, Center Forstructural Genomics Of Infectious Diseases (Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	27.39 / 1.52
Space group	I 2 2 2
Cell size a, b, c (Å), α, β, γ (°)	84.873, 84.793, 109.571, 90.00, 90.00, 90.00
R / Rfree (%)	14.5 / 16.9

The structure of Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames also contains other interesting chemical elements:

Potassium	(K)	1 atom
Chlorine	(Cl)	4 atoms

The binding sites of Zinc atom in the Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames (pdb code 5f6q). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 3 binding sites of Zinc where determined in the Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames, PDB code: 5f6q:
Jump to Zinc binding site number: 1; 2; 3;

Zinc binding site 1 out of 3 in the Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn201 b:18.9 occ:1.00 O1 A:SO4202 2.0 19.6 1.0 OE1 A:GLU115 2.0 18.9 1.0 NE2 A:HIS66 2.1 15.3 1.0 O2 A:SO4202 2.9 21.4 1.0 CD A:GLU115 3.0 18.1 1.0 S A:SO4202 3.0 20.1 1.0 CD2 A:HIS66 3.0 17.7 1.0 CE1 A:HIS66 3.0 17.3 1.0 OE2 A:GLU115 3.3 19.5 1.0 O A:HOH344 3.9 18.9 1.0 O4 A:SO4202 3.9 21.6 1.0 OH A:TYR105 4.0 19.7 1.0 CE1 A:TYR105 4.0 19.7 1.0 O3 A:SO4202 4.1 19.5 1.0 ND1 A:HIS66 4.1 17.5 1.0 CG A:HIS66 4.2 16.6 1.0 CG A:GLU115 4.3 18.1 1.0 CB A:ALA68 4.4 19.5 1.0 CZ A:TYR105 4.5 19.3 1.0 CB A:GLU115 4.6 18.1 1.0 OH A:TYR64 4.7 20.4 1.0

Zinc binding site 2 out of 3 in the Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn204 b:25.6 occ:1.00 OE2 B:GLU81 2.0 28.0 1.0 NE2 A:HIS134 2.1 24.3 1.0 CL A:CL205 2.3 32.8 1.0 CD B:GLU81 2.7 29.1 1.0 OE1 B:GLU81 2.8 30.6 1.0 CD2 A:HIS134 3.0 23.1 1.0 CE1 A:HIS134 3.1 23.7 1.0 CG A:HIS134 4.1 23.4 1.0 ND1 A:HIS134 4.2 25.0 1.0 CG B:GLU81 4.2 28.4 1.0 CD1 B:ILE84 4.3 26.4 1.0 CB A:LYS133 4.5 25.1 1.0 CB B:GLU81 4.8 27.4 1.0 CA B:GLU81 5.0 23.8 1.0

Zinc binding site 3 out of 3 in the Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames within 5.0Å range: probe atom residue distance (Å) B Occ B:Zn201 b:18.9 occ:1.00 OE1 B:GLU115 1.9 21.9 1.0 O4 B:SO4202 2.0 21.1 1.0 NE2 B:HIS66 2.1 18.3 1.0 CD B:GLU115 2.9 19.1 1.0 O1 B:SO4202 2.9 24.5 1.0 CE1 B:HIS66 3.0 18.1 1.0 CD2 B:HIS66 3.0 19.5 1.0 S B:SO4202 3.0 21.6 1.0 OE2 B:GLU115 3.3 19.6 1.0 O B:HOH343 3.9 18.7 1.0 O3 B:SO4202 4.0 24.0 1.0 CE2 B:TYR105 4.0 18.8 1.0 OH B:TYR105 4.0 20.8 1.0 O2 B:SO4202 4.1 22.7 1.0 ND1 B:HIS66 4.1 19.3 1.0 CG B:HIS66 4.2 18.7 1.0 CG B:GLU115 4.3 18.2 1.0 CB B:ALA68 4.3 18.4 1.0 CZ B:TYR105 4.5 19.0 1.0 CB B:GLU115 4.6 17.4 1.0 OH B:TYR64 4.8 23.6 1.0

N.Maltseva, Y.Kim, J.Osipiuk, W.F.Anderson, A.Joachimiak, Center For Structural Genomics Of Infectious Diseases(Csgid). Crystal Structure of Metallothiol Transferase From Bacillus Anthracis Str. Ames To Be Published.