Iron in PDB 5a1l: Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty with S21056A

The structure of Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty with S21056A, PDB code: 5a1l was solved by V.Srikannathasan, C.Gileadi, C.Johansson, T.Krojer, A.Tumber, F.Von Delft, C.H.Arrowsmith, C.Bountra, A.Edwards, P.Brennan, U.Oppermann, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	81.12 / 2.00
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	90.711, 110.500, 119.460, 90.00, 90.00, 90.00
R / Rfree (%)	18.8 / 22.5

The structure of Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty with S21056A 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 with S21056A (pdb code 5a1l). 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 with S21056A, PDB code: 5a1l:
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 with S21056A


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 with S21056A within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe1 b:21.3 occ:1.00 O A:HOH3002 2.1 16.6 1.0 N14 A:S2I2267 2.2 22.8 1.0 O A:HOH3001 2.2 22.7 1.0 OE2 A:GLU1016 2.3 17.8 1.0 NE2 A:HIS1014 2.4 18.3 1.0 N15 A:S2I2267 2.4 20.2 1.0 C09 A:S2I2267 3.1 23.5 1.0 C13 A:S2I2267 3.1 24.5 1.0 C08 A:S2I2267 3.1 22.7 1.0 CD A:GLU1016 3.2 17.1 1.0 CD2 A:HIS1014 3.3 18.3 1.0 C04 A:S2I2267 3.3 20.8 1.0 CE1 A:HIS1014 3.4 17.9 1.0 N03 A:S2I2267 3.4 22.0 1.0 OE1 A:GLU1016 3.4 18.7 1.0 NE2 A:HIS1094 3.9 16.2 1.0 O A:HOH3162 4.2 30.6 1.0 CE1 A:HIS1094 4.3 16.9 1.0 O A:HOH3182 4.3 31.5 1.0 CG A:HIS1014 4.4 18.1 1.0 ND1 A:HIS1014 4.4 18.2 1.0 C10 A:S2I2267 4.4 26.5 1.0 C12 A:S2I2267 4.5 25.8 1.0 N07 A:S2I2267 4.5 22.6 1.0 CG A:GLU1016 4.6 16.3 1.0 C05 A:S2I2267 4.7 22.2 1.0 C02 A:S2I2267 4.8 22.5 1.0 O A:HOH3173 4.9 27.5 1.0

Iron binding site 2 out of 2 in the Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty with S21056A


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 with S21056A within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe1 b:22.3 occ:1.00 O B:HOH3002 2.1 25.9 1.0 OE2 B:GLU1016 2.1 19.1 1.0 O B:HOH3001 2.2 18.6 1.0 N14 B:S2I2267 2.2 24.6 1.0 N15 B:S2I2267 2.4 24.2 1.0 NE2 B:HIS1014 2.4 17.7 1.0 C13 B:S2I2267 3.1 25.8 1.0 C09 B:S2I2267 3.1 25.0 1.0 CD B:GLU1016 3.1 19.0 1.0 C08 B:S2I2267 3.1 26.2 1.0 CD2 B:HIS1014 3.3 16.8 1.0 OE1 B:GLU1016 3.4 20.8 1.0 C04 B:S2I2267 3.4 24.6 1.0 CE1 B:HIS1014 3.4 17.7 1.0 N03 B:S2I2267 3.5 26.8 1.0 NE2 B:HIS1094 3.9 18.5 1.0 CE1 B:HIS1094 4.3 18.0 1.0 O B:HOH3139 4.3 36.5 1.0 C12 B:S2I2267 4.4 27.4 1.0 C10 B:S2I2267 4.4 27.1 1.0 CG B:HIS1014 4.5 16.9 1.0 O B:HOH3157 4.5 27.0 1.0 N07 B:S2I2267 4.5 25.2 1.0 ND1 B:HIS1014 4.5 16.3 1.0 CG B:GLU1016 4.5 17.9 1.0 C05 B:S2I2267 4.7 24.4 1.0 C02 B:S2I2267 4.8 27.4 1.0 O B:HOH3149 4.9 33.7 1.0 C11 B:S2I2267 4.9 28.8 1.0

V.Srikannathasan, C.Gileadi, C.Johansson, T.Krojer, A.Tumber, F.Von Delft, C.H.Arrowsmith, C.Bountra, A.Edwards, P.Brennan, U.Oppermann. Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty with S21056A To Be Published.