Iron in PDB 2fiy: The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa

The structure of The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa, PDB code: 2fiy was solved by R.Zhang, E.Evdokimova, A.Savchenko, A.Edwards, A.Joachimiak, Midwestcenter For Structural Genomics (Mcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	96.67 / 2.10
Space group	P 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	46.261, 96.617, 140.620, 90.00, 90.00, 90.00
R / Rfree (%)	19.7 / 24.3

The binding sites of Iron atom in the The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa (pdb code 2fiy). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 5 binding sites of Iron where determined in the The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa, PDB code: 2fiy:
Jump to Iron binding site number: 1; 2; 3; 4; 5;

Iron binding site 1 out of 5 in the The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe401 b:32.3 occ:1.00 SG A:CYS185 2.3 28.4 1.0 SG A:CYS214 2.3 28.8 1.0 SG A:CYS188 2.3 27.7 1.0 SG A:CYS211 2.4 29.8 1.0 CB A:CYS185 3.1 28.2 1.0 CB A:CYS211 3.1 30.0 1.0 CB A:CYS188 3.3 27.1 1.0 CB A:CYS214 3.3 31.1 1.0 N A:CYS188 3.7 26.9 1.0 N A:CYS214 3.8 30.0 1.0 CA A:CYS188 4.1 27.7 1.0 CA A:CYS214 4.1 30.4 1.0 CB A:CYS216 4.4 32.7 1.0 CB A:ALA187 4.4 27.5 1.0 CA A:CYS211 4.6 30.1 1.0 CA A:CYS185 4.6 28.6 1.0 CB A:LEU213 4.7 30.3 1.0 C A:ALA187 4.7 27.1 1.0 C A:CYS188 4.7 28.2 1.0 C A:CYS214 4.7 30.4 1.0 N A:CYS216 4.7 32.4 1.0 CB A:SER190 4.8 29.4 1.0 N A:GLY189 4.8 28.6 1.0 N A:ALA215 4.8 31.1 1.0 N A:SER190 4.9 29.0 1.0 CA A:ALA187 4.9 27.1 1.0 C A:LEU213 4.9 30.1 1.0 N A:ALA187 4.9 27.5 1.0 OG A:SER190 5.0 31.2 1.0

Iron binding site 2 out of 5 in the The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe403 b:58.8 occ:1.00 SG A:CYS259 1.9 33.8 1.0 SG A:CYS256 2.4 36.5 1.0 SG A:CYS228 2.4 45.2 1.0 SG A:CYS225 2.6 36.5 1.0 CB A:CYS259 3.1 37.7 1.0 CB A:CYS256 3.3 36.5 1.0 CB A:CYS225 3.3 37.3 1.0 CB A:CYS228 3.4 45.3 1.0 N A:CYS259 3.5 37.7 1.0 CA A:CYS259 3.8 37.4 1.0 N A:CYS228 3.9 44.7 1.0 O A:CYS228 4.0 46.9 1.0 CA A:CYS228 4.1 45.3 1.0 C A:CYS228 4.3 46.3 1.0 C A:SER258 4.5 37.6 1.0 C A:CYS259 4.6 37.7 1.0 CB A:SER258 4.7 37.5 1.0 CA A:CYS256 4.7 36.3 1.0 O A:CYS256 4.8 37.4 1.0 CA A:CYS225 4.8 37.9 1.0 C A:CYS256 4.9 36.7 1.0 N A:GLN260 4.9 38.1 1.0 O A:HOH568 5.0 65.6 1.0 CA A:SER258 5.0 37.5 1.0

Iron binding site 3 out of 5 in the The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 3 of The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe402 b:36.1 occ:1.00 SG B:CYS185 2.3 33.1 1.0 SG B:CYS214 2.3 35.3 1.0 SG B:CYS188 2.4 33.4 1.0 SG B:CYS211 2.4 35.5 1.0 CB B:CYS185 3.1 34.2 1.0 CB B:CYS211 3.2 35.1 1.0 CB B:CYS188 3.4 32.6 1.0 CB B:CYS214 3.4 35.0 1.0 N B:CYS214 3.8 34.9 1.0 N B:CYS188 3.8 32.7 1.0 CA B:CYS188 4.1 33.0 1.0 CA B:CYS214 4.1 35.3 1.0 CB B:ALA187 4.4 33.4 1.0 CB B:CYS216 4.4 38.3 1.0 CA B:CYS185 4.5 34.5 1.0 CA B:CYS211 4.6 35.5 1.0 C B:ALA187 4.7 33.1 1.0 CB B:SER190 4.7 33.6 1.0 C B:CYS214 4.7 35.3 1.0 C B:CYS188 4.8 33.5 1.0 CB B:LEU213 4.8 35.9 1.0 N B:ALA215 4.8 35.5 1.0 N B:GLY189 4.8 33.6 1.0 N B:CYS216 4.8 37.7 1.0 N B:SER190 4.9 33.7 1.0 CA B:ALA187 4.9 33.5 1.0 N B:ALA187 4.9 33.4 1.0 C B:LEU213 5.0 35.6 1.0 OG B:SER190 5.0 32.7 1.0

Iron binding site 4 out of 5 in the The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 4 of The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe404 b:59.5 occ:1.00 SG B:CYS259 1.7 40.2 1.0 SG B:CYS228 2.1 46.1 1.0 SG B:CYS256 2.4 37.4 1.0 SG B:CYS225 2.4 39.1 1.0 CB B:CYS228 2.5 42.7 1.0 CB B:CYS225 3.0 39.5 1.0 CB B:CYS256 3.1 37.3 1.0 CB B:CYS259 3.4 40.0 1.0 N B:CYS228 3.6 42.0 1.0 CA B:CYS228 3.6 42.6 1.0 N B:CYS259 3.7 40.0 1.0 CA B:CYS259 4.2 39.7 1.0 CA B:CYS225 4.4 40.1 1.0 CB B:SER258 4.5 40.4 1.0 CB B:GLU230 4.6 43.0 1.0 CA B:CYS256 4.6 37.8 1.0 C B:CYS228 4.6 42.7 1.0 C B:SER258 4.7 40.1 1.0 N B:GLU229 4.8 42.9 1.0 C B:HIS227 4.8 41.3 1.0 N B:GLU230 4.9 43.1 1.0 N B:SER258 4.9 40.3 1.0 O B:HOH520 4.9 70.2 1.0 CA B:SER258 4.9 40.1 1.0 C B:CYS256 5.0 38.0 1.0 O B:CYS256 5.0 38.5 1.0

Iron binding site 5 out of 5 in the The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 5 of The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe405 b:65.1 occ:1.00 NE2 B:HIS22 2.1 48.6 1.0 NE2 B:HIS219 2.1 36.1 1.0 NE2 B:HIS20 2.1 54.5 1.0 CD2 B:HIS219 2.9 35.8 1.0 CD2 B:HIS22 3.0 48.9 1.0 CE1 B:HIS20 3.0 54.8 1.0 CE1 B:HIS22 3.1 48.9 1.0 CD2 B:HIS20 3.1 54.6 1.0 CE1 B:HIS219 3.2 35.7 1.0 CG B:HIS219 4.1 36.4 1.0 ND1 B:HIS20 4.2 55.1 1.0 CG B:HIS22 4.2 49.5 1.0 ND1 B:HIS22 4.2 50.3 1.0 CG B:HIS20 4.2 54.8 1.0 ND1 B:HIS219 4.2 36.7 1.0 OH B:TYR208 4.4 36.0 1.0 CE2 B:TYR208 4.5 36.1 1.0 CZ B:TYR208 5.0 36.5 1.0

R.Zhang, E.Evdokimova, A.Savchenko, A.Edwards, A.Joachimiak. The Crystal Structure of the Fdhe Protein From Pseudomonas Aeruginosa PAO1 To Be Published.