Iron in PDB 3ree: Crystal Structure of Mitoneet

The structure of Crystal Structure of Mitoneet, PDB code: 3ree was solved by M.O.Funk, W.Arif, S.Xu, T.C.Mueser, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.32 / 1.76
Space group	I 41 2 2
Cell size a, b, c (Å), α, β, γ (°)	58.640, 58.640, 177.610, 90.00, 90.00, 90.00
R / Rfree (%)	20.2 / 22.9

The binding sites of Iron atom in the Crystal Structure of Mitoneet (pdb code 3ree). 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 Mitoneet, PDB code: 3ree:
Jump to Iron binding site number: 1; 2;

Iron binding site 1 out of 2 in the Crystal Structure of Mitoneet


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 Mitoneet within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe204 b:21.1 occ:1.00 FE1 A:FES204 0.0 21.1 1.0 S2 A:FES204 2.1 23.2 1.0 S1 A:FES204 2.2 20.4 1.0 SG A:CYS72 2.3 19.2 1.0 SG A:CYS74 2.3 19.0 1.0 FE2 A:FES204 2.7 21.7 1.0 CB A:CYS72 3.3 20.7 1.0 CB A:CYS74 3.4 20.1 1.0 N A:CYS74 3.6 15.2 1.0 CA A:CYS72 3.7 20.5 1.0 N A:ARG73 3.8 15.8 1.0 CA A:CYS74 3.9 18.7 1.0 CB A:HIS87 4.0 21.0 1.0 C A:CYS72 4.2 19.9 1.0 ND1 A:HIS87 4.2 18.7 1.0 N A:HIS87 4.3 23.5 1.0 N A:TRP75 4.4 18.0 1.0 C A:CYS74 4.4 16.5 1.0 N A:SER77 4.5 21.1 1.0 CB A:SER77 4.5 25.1 1.0 CA A:HIS87 4.5 22.6 1.0 CG A:HIS87 4.6 23.7 1.0 C A:ARG73 4.7 15.3 1.0 SG A:CYS83 4.7 24.6 1.0 N A:ARG76 4.7 18.7 1.0 CA A:CYS83 4.8 25.1 1.0 CB A:CYS83 4.9 25.5 1.0 CA A:ARG73 4.9 16.1 1.0 N A:CYS72 5.0 20.8 1.0 CA A:SER77 5.0 23.0 1.0

Iron binding site 2 out of 2 in the Crystal Structure of Mitoneet


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 Mitoneet within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe204 b:21.7 occ:1.00 FE2 A:FES204 0.0 21.7 1.0 ND1 A:HIS87 2.1 18.7 1.0 S1 A:FES204 2.2 20.4 1.0 S2 A:FES204 2.2 23.2 1.0 SG A:CYS83 2.3 24.6 1.0 FE1 A:FES204 2.7 21.1 1.0 CE1 A:HIS87 3.0 29.2 1.0 CG A:HIS87 3.2 23.7 1.0 CB A:CYS83 3.4 25.5 1.0 CB A:HIS87 3.6 21.0 1.0 CA A:CYS83 3.8 25.1 1.0 N A:GLY85 4.0 28.1 1.0 N A:HIS87 4.0 23.5 1.0 NE2 A:HIS87 4.2 24.4 1.0 CB A:PRO100 4.2 22.4 1.0 N A:ASP84 4.3 25.7 1.0 CD2 A:HIS87 4.3 26.6 1.0 CD A:PRO100 4.3 19.3 1.0 CA A:HIS87 4.4 22.6 1.0 CA A:GLY85 4.4 28.0 1.0 C A:CYS83 4.4 25.4 1.0 SG A:CYS74 4.4 19.0 1.0 N A:ALA86 4.4 23.4 1.0 CG A:PRO100 4.5 23.7 1.0 SG A:CYS72 4.6 19.2 1.0 C A:GLY85 4.7 28.2 1.0 CA A:CYS72 4.7 20.5 1.0 CB A:CYS72 4.7 20.7 1.0 N A:PRO100 4.8 21.8 1.0 CA A:PRO100 5.0 22.4 1.0

W.Arif, S.Xu, D.Isailovic, W.J.Geldenhuys, R.T.Carroll, M.O.Funk. Complexes of the Outer Mitochondrial Membrane Protein Mitoneet with Resveratrol-3-Sulfate. Biochemistry V. 50 5806 2011.
ISSN: ISSN 0006-2960
PubMed: 21591687
DOI: 10.1021/BI200546S