Mercury in PDB 3efu: X-Ray Structure of Human Ubiquitin-Hg(II) Adduct

The structure of X-Ray Structure of Human Ubiquitin-Hg(II) Adduct, PDB code: 3efu was solved by G.Falini, S.Fermani, G.Tosi, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	24.49 / 1.84
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	28.024, 42.828, 50.374, 90.00, 90.00, 90.00
R / Rfree (%)	23.5 / 29.3

The binding sites of Mercury atom in the X-Ray Structure of Human Ubiquitin-Hg(II) Adduct (pdb code 3efu). This binding sites where shown within 5.0 Angstroms radius around Mercury atom.
In total only one binding site of Mercury was determined in the X-Ray Structure of Human Ubiquitin-Hg(II) Adduct, PDB code: 3efu:

Mercury binding site 1 out of 1 in the X-Ray Structure of Human Ubiquitin-Hg(II) Adduct


Mono view


Stereo pair view

A full contact list of Mercury with other atoms in the Hg binding site number 1 of X-Ray Structure of Human Ubiquitin-Hg(II) Adduct within 5.0Å range: probe atom residue distance (Å) B Occ A:Hg100 b:28.4 occ:0.77 NE2 A:HIS68 2.2 19.2 1.0 O A:HOH198 2.8 27.9 1.0 CD2 A:HIS68 3.0 19.9 1.0 CE1 A:HIS68 3.4 19.6 1.0 O A:HOH109 3.7 22.5 1.0 CG A:HIS68 4.3 17.3 1.0 O A:HOH124 4.3 24.0 1.0 ND1 A:HIS68 4.4 17.9 1.0 O A:HOH120 4.4 17.0 1.0 O A:THR66 4.6 14.1 1.0 CG2 A:THR66 4.7 12.4 1.0 CB A:THR66 4.8 15.2 1.0

G.Falini, S.Fermani, G.Tosi, F.Arnesano, G.Natile. Structural Probing of Zn(II), Cd(II) and Hg(II) Binding to Human Ubiquitin. Chem.Commun.(Camb.) V. 45 5960 2008.
ISSN: ISSN 1359-7345
PubMed: 19030552
DOI: 10.1039/B813463D