Mercury in PDB 3fn8: Crystal Structure of Merb Complexed with Mercury

All present enzymatic activity of Crystal Structure of Merb Complexed with Mercury:
4.99.1.2;

The structure of Crystal Structure of Merb Complexed with Mercury, PDB code: 3fn8 was solved by C.Momany, A.Summers, C.Cagle, J.Teske, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	46.32 / 1.88
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	38.638, 88.972, 54.680, 90.00, 97.16, 90.00
R / Rfree (%)	18.4 / 24.8

The binding sites of Mercury atom in the Crystal Structure of Merb Complexed with Mercury (pdb code 3fn8). This binding sites where shown within 5.0 Angstroms radius around Mercury atom.
In total 2 binding sites of Mercury where determined in the Crystal Structure of Merb Complexed with Mercury, PDB code: 3fn8:
Jump to Mercury binding site number: 1; 2;

Mercury binding site 1 out of 2 in the Crystal Structure of Merb Complexed with Mercury


Mono view


Stereo pair view

A full contact list of Mercury with other atoms in the Hg binding site number 1 of Crystal Structure of Merb Complexed with Mercury within 5.0Å range: probe atom residue distance (Å) B Occ A:Hg221 b:37.0 occ:0.70 SG A:CYS159 2.3 42.0 1.0 SG A:CYS96 2.4 38.0 1.0 O A:HOH263 2.5 47.5 1.0 OD2 A:ASP99 2.9 46.1 1.0 CB A:CYS96 3.2 35.5 1.0 CG A:ASP99 3.4 42.8 1.0 CB A:CYS159 3.4 37.3 1.0 OD1 A:ASP99 3.4 49.6 1.0 CA A:CYS159 3.7 37.8 1.0 CD2 A:PHE158 3.8 32.9 1.0 CE2 A:PHE158 3.9 33.4 1.0 N A:CYS96 4.0 34.9 1.0 CB A:TRP95 4.1 34.4 1.0 CA A:CYS96 4.2 35.5 1.0 O1 A:GOL222 4.2 90.0 1.0 C A:TRP95 4.2 34.3 1.0 O A:HOH255 4.3 49.0 1.0 N A:CYS159 4.3 36.7 1.0 CB A:ASP99 4.6 39.2 1.0 O A:TRP95 4.6 34.0 1.0 CA A:TRP95 4.8 34.4 1.0 C A:CYS159 4.9 37.6 1.0

Mercury binding site 2 out of 2 in the Crystal Structure of Merb Complexed with Mercury


Mono view


Stereo pair view

A full contact list of Mercury with other atoms in the Hg binding site number 2 of Crystal Structure of Merb Complexed with Mercury within 5.0Å range: probe atom residue distance (Å) B Occ B:Hg221 b:37.9 occ:0.70 SG B:CYS159 2.1 37.2 1.0 SG B:CYS96 2.3 32.8 1.0 OD2 B:ASP99 2.9 39.5 1.0 OD1 B:ASP99 2.9 45.3 1.0 CG B:ASP99 3.2 36.2 1.0 CB B:CYS96 3.2 31.9 1.0 CB B:CYS159 3.3 34.5 1.0 O B:HOH389 3.6 49.1 1.0 CA B:CYS159 3.7 34.6 1.0 N B:CYS96 3.9 31.6 1.0 CD2 B:PHE158 4.0 35.9 1.0 CE2 B:PHE158 4.1 35.6 1.0 CA B:CYS96 4.1 32.0 1.0 CB B:TRP95 4.2 30.8 1.0 O1 B:GOL222 4.3 68.9 1.0 C B:TRP95 4.4 31.3 1.0 N B:CYS159 4.4 34.8 1.0 CB B:ASP99 4.5 35.1 1.0 C1 B:GOL222 4.7 69.0 1.0 C B:CYS96 4.9 31.9 1.0 CA B:TRP95 4.9 31.2 1.0 N B:ASP99 4.9 34.4 1.0 C B:CYS159 4.9 34.2 1.0 O B:TRP95 4.9 31.8 1.0

C.Momany, A.Summers, C.Cagle, J.Teske. Crystal Structure of Merb Complexed with Mercury To Be Published.