Iron in PDB 5v3u: Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis: TRP90LEU Mutant

The structure of Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis: TRP90LEU Mutant, PDB code: 5v3u was solved by C.L.Varnado, E.Sorelle, J.Soman, J.S.Olson, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	42.95 / 2.50
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	50.216, 122.162, 112.934, 90.00, 90.00, 90.00
R / Rfree (%)	18.9 / 22.4

The binding sites of Iron atom in the Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis: TRP90LEU Mutant (pdb code 5v3u). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 2 binding sites of Iron where determined in the Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis: TRP90LEU Mutant, PDB code: 5v3u:
Jump to Iron binding site number: 1; 2;

Iron binding site 1 out of 2 in the Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis: TRP90LEU Mutant


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis: TRP90LEU Mutant within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe201 b:36.5 occ:1.00 FE A:HEM201 0.0 36.5 1.0 C A:CYN202 1.9 37.9 1.0 NA A:HEM201 2.0 46.6 1.0 ND A:HEM201 2.0 54.8 1.0 NE2 A:HIS77 2.0 32.0 1.0 NB A:HEM201 2.0 42.5 1.0 NC A:HEM201 2.1 43.0 1.0 CE1 A:HIS77 2.9 39.9 1.0 C4D A:HEM201 3.0 54.6 1.0 C1A A:HEM201 3.0 49.9 1.0 C4A A:HEM201 3.0 48.3 1.0 C1B A:HEM201 3.1 41.6 1.0 N A:CYN202 3.1 38.0 1.0 C4B A:HEM201 3.1 38.9 1.0 C1D A:HEM201 3.1 53.9 1.0 CD2 A:HIS77 3.1 34.6 1.0 C1C A:HEM201 3.1 35.5 1.0 C4C A:HEM201 3.1 46.5 1.0 CHA A:HEM201 3.3 53.8 1.0 CHB A:HEM201 3.4 41.3 1.0 CHC A:HEM201 3.5 36.6 1.0 CHD A:HEM201 3.5 52.2 1.0 ND1 A:HIS77 4.0 40.7 1.0 CG A:HIS77 4.2 35.0 1.0 C3D A:HEM201 4.2 52.3 1.0 C2A A:HEM201 4.2 47.6 1.0 C3A A:HEM201 4.2 49.1 1.0 C2B A:HEM201 4.3 39.7 1.0 C3B A:HEM201 4.3 35.9 1.0 C2D A:HEM201 4.3 51.2 1.0 C3C A:HEM201 4.3 48.8 1.0 C2C A:HEM201 4.3 42.9 1.0

Iron binding site 2 out of 2 in the Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis: TRP90LEU Mutant


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis: TRP90LEU Mutant within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe201 b:32.5 occ:1.00 FE B:HEM201 0.0 32.5 1.0 ND B:HEM201 2.0 28.2 1.0 NE2 B:HIS77 2.0 29.2 1.0 NC B:HEM201 2.0 31.1 1.0 C B:CYN202 2.1 42.0 1.0 NB B:HEM201 2.1 23.7 1.0 NA B:HEM201 2.1 21.8 1.0 C1D B:HEM201 3.0 26.8 1.0 CD2 B:HIS77 3.0 28.2 1.0 CE1 B:HIS77 3.0 27.3 1.0 C4C B:HEM201 3.0 29.8 1.0 C4D B:HEM201 3.0 26.6 1.0 C1C B:HEM201 3.1 32.1 1.0 C1B B:HEM201 3.1 29.8 1.0 C1A B:HEM201 3.1 30.7 1.0 C4A B:HEM201 3.1 26.3 1.0 C4B B:HEM201 3.1 33.4 1.0 N B:CYN202 3.2 41.0 1.0 CHD B:HEM201 3.3 22.7 1.0 CHA B:HEM201 3.5 30.5 1.0 CHB B:HEM201 3.5 29.5 1.0 CHC B:HEM201 3.5 32.7 1.0 ND1 B:HIS77 4.1 24.7 1.0 CG B:HIS77 4.1 28.6 1.0 C2D B:HEM201 4.2 30.7 1.0 C3D B:HEM201 4.2 30.5 1.0 C3C B:HEM201 4.2 30.0 1.0 C2C B:HEM201 4.3 31.7 1.0 C2B B:HEM201 4.3 39.6 1.0 C3A B:HEM201 4.3 33.9 1.0 C2A B:HEM201 4.3 32.6 1.0 C3B B:HEM201 4.3 39.4 1.0 NE2 B:GLN50 5.0 30.2 1.0

C.L.Varnado, E.Sorelle, J.Soman, J.S.Olson. Crystal Structure of the Group II Truncated Hemoglobin From Bacillus Anthracis To Be Published.