Iron in PDB 6gd6: Cytochrome C in Complex with Sulfonato-Calix[8]Arene, H3 Form with Ammonium Sulfate

The structure of Cytochrome C in Complex with Sulfonato-Calix[8]Arene, H3 Form with Ammonium Sulfate, PDB code: 6gd6 was solved by M.L.Rennie, G.C.Fox, P.B.Crowley, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	35.68 / 1.20
Space group	H 3
Cell size a, b, c (Å), α, β, γ (°)	82.003, 82.003, 82.535, 90.00, 90.00, 120.00
R / Rfree (%)	11.9 / 13.6

The binding sites of Iron atom in the Cytochrome C in Complex with Sulfonato-Calix[8]Arene, H3 Form with Ammonium Sulfate (pdb code 6gd6). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total only one binding site of Iron was determined in the Cytochrome C in Complex with Sulfonato-Calix[8]Arene, H3 Form with Ammonium Sulfate, PDB code: 6gd6:

Iron binding site 1 out of 1 in the Cytochrome C in Complex with Sulfonato-Calix[8]Arene, H3 Form with Ammonium Sulfate


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Cytochrome C in Complex with Sulfonato-Calix[8]Arene, H3 Form with Ammonium Sulfate within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe201 b:9.8 occ:1.00 FE A:HEC201 0.0 9.8 1.0 ND A:HEC201 2.0 9.7 1.0 NA A:HEC201 2.0 9.9 1.0 NE2 A:HIS18 2.0 9.5 1.0 NB A:HEC201 2.1 9.5 1.0 NC A:HEC201 2.1 9.8 1.0 SD A:MET80 2.3 10.8 1.0 CE1 A:HIS18 3.0 9.3 1.0 C1D A:HEC201 3.0 10.1 1.0 C4D A:HEC201 3.0 9.9 1.0 C1B A:HEC201 3.0 9.4 1.0 C1A A:HEC201 3.0 10.1 1.0 C4A A:HEC201 3.0 10.0 1.0 C4B A:HEC201 3.0 9.8 1.0 C4C A:HEC201 3.1 10.2 1.0 CD2 A:HIS18 3.1 9.6 1.0 C1C A:HEC201 3.1 9.6 1.0 CE A:MET80 3.3 11.9 1.0 CHB A:HEC201 3.4 9.7 1.0 CG A:MET80 3.4 11.1 1.0 CHD A:HEC201 3.4 10.2 1.0 CHA A:HEC201 3.4 9.7 1.0 CHC A:HEC201 3.5 10.0 1.0 ND1 A:HIS18 4.1 9.9 1.0 CG A:HIS18 4.2 9.5 1.0 C2A A:HEC201 4.2 10.5 1.0 C3A A:HEC201 4.2 10.2 1.0 C2D A:HEC201 4.2 10.2 1.0 CB A:MET80 4.2 11.5 1.0 C2B A:HEC201 4.3 10.0 1.0 C3D A:HEC201 4.3 10.3 1.0 C2C A:HEC201 4.3 11.2 1.0 C3C A:HEC201 4.3 10.7 1.0 C3B A:HEC201 4.3 9.6 1.0 OH A:TYR67 4.9 14.3 1.0

M.L.Rennie, G.C.Fox, J.Perez, P.B.Crowley. Auto-Regulated Protein Assembly on A Supramolecular Scaffold. Angew. Chem. Int. Ed. Engl. V. 57 13764 2018.
ISSN: ESSN 1521-3773
PubMed: 30109907
DOI: 10.1002/ANIE.201807490