Iron in PDB 6r6m: KUSTA0087/KUSTA0088 Complex Purified From Kuenenia Stuttgartiensis

The structure of KUSTA0087/KUSTA0088 Complex Purified From Kuenenia Stuttgartiensis, PDB code: 6r6m was solved by M.Akram, T.Barends, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	45.37 / 1.70
Space group	P 21 21 2
Cell size a, b, c (Å), α, β, γ (°)	44.300, 130.360, 45.370, 90.00, 90.00, 90.00
R / Rfree (%)	18.8 / 21

The binding sites of Iron atom in the KUSTA0087/KUSTA0088 Complex Purified From Kuenenia Stuttgartiensis (pdb code 6r6m). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 2 binding sites of Iron where determined in the KUSTA0087/KUSTA0088 Complex Purified From Kuenenia Stuttgartiensis, PDB code: 6r6m:
Jump to Iron binding site number: 1; 2;

Iron binding site 1 out of 2 in the KUSTA0087/KUSTA0088 Complex Purified From Kuenenia Stuttgartiensis


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of KUSTA0087/KUSTA0088 Complex Purified From Kuenenia Stuttgartiensis within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe200 b:26.9 occ:1.00 FE A:HEC200 0.0 26.9 1.0 NE2 A:HIS124 2.0 22.5 1.0 NA A:HEC200 2.0 23.7 1.0 NC A:HEC200 2.0 21.9 1.0 NB A:HEC200 2.1 23.9 1.0 ND A:HEC200 2.1 25.3 1.0 SG A:CYS32 2.4 30.8 1.0 CE1 A:HIS124 3.0 26.1 1.0 C4A A:HEC200 3.0 30.9 1.0 CD2 A:HIS124 3.0 26.3 1.0 C4C A:HEC200 3.1 20.6 1.0 C1B A:HEC200 3.1 29.8 1.0 C1C A:HEC200 3.1 22.7 1.0 C1D A:HEC200 3.1 28.4 1.0 C4B A:HEC200 3.1 25.3 1.0 C1A A:HEC200 3.1 26.9 1.0 C4D A:HEC200 3.1 28.5 1.0 CHB A:HEC200 3.4 30.5 1.0 CHD A:HEC200 3.4 24.1 1.0 CHC A:HEC200 3.4 19.4 1.0 CB A:CYS32 3.5 31.4 1.0 CHA A:HEC200 3.5 25.4 1.0 ND1 A:HIS124 4.1 24.3 1.0 CG A:HIS124 4.2 27.4 1.0 C3A A:HEC200 4.2 33.7 1.0 C2A A:HEC200 4.3 34.2 1.0 C2B A:HEC200 4.3 25.1 1.0 C3C A:HEC200 4.3 21.1 1.0 C2C A:HEC200 4.3 22.6 1.0 C3B A:HEC200 4.3 21.6 1.0 C2D A:HEC200 4.3 27.8 1.0 C3D A:HEC200 4.3 24.6 1.0 NE2 A:GLN28 4.7 28.0 1.0 CA A:CYS32 4.8 30.3 1.0

Iron binding site 2 out of 2 in the KUSTA0087/KUSTA0088 Complex Purified From Kuenenia Stuttgartiensis


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of KUSTA0087/KUSTA0088 Complex Purified From Kuenenia Stuttgartiensis within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe200 b:19.6 occ:1.00 FE B:HEC200 0.0 19.6 1.0 NB B:HEC200 1.9 17.7 1.0 NE2 B:HIS58 2.0 22.9 1.0 ND B:HEC200 2.0 19.5 1.0 NC B:HEC200 2.0 22.3 1.0 NA B:HEC200 2.0 20.2 1.0 SG B:CYS101 2.4 19.9 1.0 CE1 B:HIS58 2.9 22.3 1.0 CD2 B:HIS58 3.0 22.7 1.0 C4B B:HEC200 3.0 20.6 1.0 C1B B:HEC200 3.0 20.2 1.0 C4D B:HEC200 3.0 21.7 1.0 C1D B:HEC200 3.0 19.7 1.0 C1C B:HEC200 3.0 20.8 1.0 C4A B:HEC200 3.0 16.0 1.0 C1A B:HEC200 3.1 15.4 1.0 C4C B:HEC200 3.1 20.4 1.0 CHC B:HEC200 3.4 22.7 1.0 CHA B:HEC200 3.4 16.1 1.0 CB B:CYS101 3.4 17.7 1.0 CHB B:HEC200 3.4 16.0 1.0 CHD B:HEC200 3.4 20.6 1.0 ND1 B:HIS58 4.0 22.4 1.0 CG B:HIS58 4.1 22.4 1.0 CA B:CYS101 4.2 21.9 1.0 C3B B:HEC200 4.2 18.8 1.0 C2B B:HEC200 4.2 21.6 1.0 C3D B:HEC200 4.2 17.9 1.0 C2D B:HEC200 4.3 22.7 1.0 C2C B:HEC200 4.3 18.2 1.0 C3A B:HEC200 4.3 18.1 1.0 C3C B:HEC200 4.3 20.7 1.0 C2A B:HEC200 4.3 20.1 1.0 NE2 B:HIS93 4.4 23.3 1.0

M.Akram, J.Reimann, A.Dietl, A.Menzel, W.Versantvoort, B.Kartal, M.S.M.Jetten, T.R.M.Barends. A Nitric Oxide-Binding Heterodimeric Cytochromeccomplex From the Anammox Bacteriumkuenenia Stuttgartiensisbinds to Hydrazine Synthase. J.Biol.Chem. V. 294 16712 2019.
ISSN: ESSN 1083-351X
PubMed: 31548310
DOI: 10.1074/JBC.RA119.008788