Iron in PDB 3zli: Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty

The structure of Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty, PDB code: 3zli was solved by M.Vollmar, C.Gileadi, L.Shrestha, S.Goubin, C.Johansson, T.Krojer, J.W.Raynor, A.Bradley, F.Von Delft, C.H.Arrowsmith, C.Bountra, A.Edwards, U.Oppermann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	50.01 / 1.80
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	90.585, 110.249, 118.242, 90.00, 90.00, 90.00
R / Rfree (%)	17.6 / 20.4

The structure of Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty also contains other interesting chemical elements:

Zinc

(Zn)

2 atoms

The binding sites of Iron atom in the Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty (pdb code 3zli). 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 Jmjc Domain of Human Histone Demethylase Uty, PDB code: 3zli:
Jump to Iron binding site number: 1; 2;

Iron binding site 1 out of 2 in the Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty


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 Jmjc Domain of Human Histone Demethylase Uty within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe4001 b:24.3 occ:1.00 OE2 A:GLU1095 2.0 25.2 1.0 O A:HOH2140 2.1 30.5 1.0 NE2 A:HIS1173 2.1 22.5 1.0 O1 A:AKG4000 2.1 26.4 1.0 O5 A:AKG4000 2.2 28.7 1.0 NE2 A:HIS1093 2.2 24.9 1.0 C2 A:AKG4000 2.8 30.2 1.0 C1 A:AKG4000 2.8 29.0 1.0 CE1 A:HIS1173 3.0 25.4 1.0 CE1 A:HIS1093 3.0 24.0 1.0 CD A:GLU1095 3.1 21.7 1.0 CD2 A:HIS1173 3.2 22.6 1.0 CD2 A:HIS1093 3.3 25.4 1.0 OE1 A:GLU1095 3.6 23.5 1.0 O2 A:EDO2351 4.0 50.4 1.0 O2 A:AKG4000 4.1 24.8 1.0 ND1 A:HIS1173 4.1 23.5 1.0 ND1 A:HIS1093 4.2 24.2 1.0 O A:HOH2141 4.2 55.7 1.0 OG A:SER1101 4.2 20.9 0.5 CG A:HIS1173 4.2 21.9 1.0 C3 A:AKG4000 4.3 31.2 1.0 CG A:GLU1095 4.3 22.3 1.0 CG A:HIS1093 4.3 25.0 1.0 OG A:SER1101 4.5 20.4 0.5 CB A:SER1101 4.7 21.0 0.5 CB A:SER1101 4.8 21.3 0.5

Iron binding site 2 out of 2 in the Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty


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 Jmjc Domain of Human Histone Demethylase Uty within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe4001 b:25.7 occ:1.00 OE2 B:GLU1095 2.0 25.1 1.0 O B:HOH2121 2.1 27.9 1.0 O5 B:AKG4000 2.1 33.5 1.0 NE2 B:HIS1173 2.2 24.8 1.0 NE2 B:HIS1093 2.2 23.7 1.0 O1 B:AKG4000 2.2 27.2 1.0 C2 B:AKG4000 2.8 32.9 1.0 C1 B:AKG4000 2.9 31.1 1.0 CE1 B:HIS1093 3.0 24.0 1.0 CE1 B:HIS1173 3.0 25.2 1.0 CD B:GLU1095 3.1 24.9 1.0 CD2 B:HIS1173 3.2 23.1 1.0 CD2 B:HIS1093 3.3 23.6 1.0 OE1 B:GLU1095 3.6 25.2 1.0 O2 B:EDO2350 4.1 59.0 1.0 O2 B:AKG4000 4.1 25.1 1.0 ND1 B:HIS1173 4.2 25.8 1.0 ND1 B:HIS1093 4.2 22.4 1.0 C3 B:AKG4000 4.2 36.2 1.0 O B:HOH2122 4.3 55.3 1.0 CG B:HIS1173 4.3 23.8 1.0 CG B:GLU1095 4.3 22.9 1.0 OG B:SER1101 4.3 25.4 0.5 CG B:HIS1093 4.4 22.8 1.0 OG B:SER1101 4.5 25.4 0.5 CB B:SER1101 4.8 25.1 0.5 C2 B:EDO2350 4.8 45.6 1.0 CB B:SER1101 4.9 24.9 0.5

L.J.Walport, R.J.Hopkinson, M.Vollmar, S.K.Madden, C.Gileadi, U.Oppermann, C.J.Schofield, C.Johansson. Human Uty(KDM6C) Is A Male-Specific Nepsilon-Methyl Lysyl Demethylase. J.Biol.Chem. V. 289 18302 2014.
ISSN: ISSN 0021-9258
PubMed: 24798337
DOI: 10.1074/JBC.M114.555052