Manganese in PDB 5fy1: Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B

The structure of Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B, PDB code: 5fy1 was solved by R.Nowak, T.Krojer, C.Johansson, C.Gileadi, K.Kupinska, N.M.Pearce, F.Vondelft, 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)	47.19 / 1.78
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	91.710, 110.080, 118.130, 90.00, 90.00, 90.00
R / Rfree (%)	20.1 / 23.9

The structure of Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B also contains other interesting chemical elements:

Zinc

(Zn)

2 atoms

The binding sites of Manganese atom in the Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B (pdb code 5fy1). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total 2 binding sites of Manganese where determined in the Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B, PDB code: 5fy1:
Jump to Manganese binding site number: 1; 2;

Manganese binding site 1 out of 2 in the Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B within 5.0Å range: probe atom residue distance (Å) B Occ A:Mn2346 b:30.4 occ:1.00 O A:HOH2148 1.8 27.2 1.0 OE2 A:GLU1095 2.0 25.2 1.0 NE2 A:HIS1173 2.3 18.4 1.0 O A:HOH2149 2.3 36.3 1.0 NE2 A:HIS1093 2.3 29.5 1.0 O A:HOH2156 2.4 29.4 1.0 CE1 A:HIS1093 3.1 28.3 1.0 CE1 A:HIS1173 3.1 34.7 1.0 CD A:GLU1095 3.2 26.7 1.0 CD2 A:HIS1173 3.3 18.4 1.0 CD2 A:HIS1093 3.5 28.2 1.0 OE1 A:GLU1095 3.8 21.2 1.0 O A:HOH2251 3.9 48.1 1.0 O A:HOH2159 4.0 35.0 1.0 O2 A:EDO2360 4.1 43.9 1.0 O A:HOH2155 4.3 46.5 1.0 ND1 A:HIS1093 4.3 24.7 1.0 ND1 A:HIS1173 4.3 17.1 1.0 CG A:GLU1095 4.3 18.3 1.0 CG A:HIS1173 4.4 27.4 1.0 CG A:HIS1093 4.5 29.9 1.0 OG A:SER1101 4.5 22.4 0.6 O A:DMS2349 4.7 49.3 1.0 OG A:SER1101 4.7 24.4 0.4 CB A:SER1101 4.9 24.4 0.4 CB A:SER1101 5.0 24.4 0.6

Manganese binding site 2 out of 2 in the Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B within 5.0Å range: probe atom residue distance (Å) B Occ B:Mn2353 b:29.5 occ:1.00 O B:HOH2133 1.9 27.1 1.0 OE2 B:GLU1095 2.2 25.4 1.0 O B:HOH2185 2.2 30.4 1.0 O B:HOH2142 2.2 27.1 1.0 NE2 B:HIS1173 2.4 25.4 1.0 NE2 B:HIS1093 2.4 24.5 1.0 CE1 B:HIS1093 3.1 28.2 1.0 CE1 B:HIS1173 3.2 24.9 1.0 CD B:GLU1095 3.3 27.5 1.0 CD2 B:HIS1173 3.4 22.0 1.0 CD2 B:HIS1093 3.6 23.9 1.0 O B:HOH2148 3.8 32.5 1.0 OE1 B:GLU1095 3.9 30.1 1.0 O2 B:EDO2362 3.9 46.2 1.0 O B:HOH2134 4.2 45.4 1.0 ND1 B:HIS1093 4.3 22.5 1.0 ND1 B:HIS1173 4.4 23.9 1.0 CG B:GLU1095 4.5 18.8 1.0 CG B:HIS1173 4.5 25.8 1.0 OG B:SER1101 4.5 37.0 1.0 CG B:HIS1093 4.6 23.6 1.0 O B:DMS2354 4.7 46.5 1.0 O B:HOH2230 4.8 47.4 1.0 CB B:SER1101 4.9 25.7 1.0

R.Nowak, T.Krojer, C.Johansson, C.Gileadi, K.Kupinska, N.M.Pearce, F.Von Delft, C.H.Arrowsmith, C.Bountra, A.Edwards, U.Oppermann. Crystal Structure of Jmjc Domain of Human Histone Demethylase Uty in Complex with N08619B To Be Published.