Mercury in PDB 4fj4: Crystal Structure of the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50

The structure of Crystal Structure of the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50, PDB code: 4fj4 was solved by A.Kuzin, Y.Chen, S.M.Vorobiev, J.Seetharaman, J.Janjua, R.Xiao, K.Cunningham, M.Maglaqui, L.A.Owens, H.Wang, J.K.Everett, T.B.Acton, G.T.Montelione, J.F.Hunt, L.Tong, Northeast Structural Genomicsconsortium (Nesg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	39.84 / 2.10
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	44.812, 85.107, 113.485, 90.00, 90.00, 90.00
R / Rfree (%)	19.9 / 25.6

The structure of Crystal Structure of the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50 also contains other interesting chemical elements:

Sodium

(Na)

2 atoms

The binding sites of Mercury atom in the Crystal Structure of the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50 (pdb code 4fj4). 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 the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50, PDB code: 4fj4:
Jump to Mercury binding site number: 1; 2;

Mercury binding site 1 out of 2 in the Crystal Structure of the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50


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 the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50 within 5.0Å range: probe atom residue distance (Å) B Occ A:Hg201 b:59.7 occ:0.40 HG A:EMC201 0.0 59.7 0.4 C1 A:EMC201 2.0 15.2 0.2 C1 A:EMC201 2.0 15.2 0.2 SG A:CYS167 2.7 36.2 1.0 C2 A:EMC201 2.9 15.2 0.2 C2 A:EMC201 3.0 15.2 0.2 CD2 A:PHE158 3.3 50.3 1.0 CB A:CYS167 3.4 25.8 1.0 O A:SER166 3.5 36.6 1.0 CA A:CYS167 3.7 25.3 1.0 CB A:PHE158 4.0 32.9 1.0 CG A:PHE158 4.0 42.0 1.0 C A:SER166 4.0 33.0 1.0 CB A:PHE165 4.1 32.9 1.0 CE2 A:PHE158 4.1 53.1 1.0 N A:CYS167 4.2 26.7 1.0 N A:PHE158 4.5 25.7 1.0 CD2 A:PHE165 4.7 57.5 1.0 CG A:PHE165 4.8 44.8 1.0 CA A:PHE158 4.9 29.3 1.0 N A:SER166 4.9 31.4 1.0

Mercury binding site 2 out of 2 in the Crystal Structure of the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50


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 the Protein Q9HRE7 Complexed with Mercury From Halobacterium Salinarium at the Resolution 2.1A, Northeast Structural Genomics Consortium Target HSR50 within 5.0Å range: probe atom residue distance (Å) B Occ B:Hg201 b:50.1 occ:0.40 HG B:EMC201 0.0 50.1 0.4 C1 B:EMC201 2.0 15.2 0.2 SG B:CYS167 2.7 33.8 1.0 C2 B:EMC201 2.9 15.2 0.2 CD2 B:PHE158 3.1 50.7 1.0 O B:SER166 3.2 37.4 1.0 CB B:CYS167 3.5 30.6 1.0 CA B:CYS167 3.7 32.3 1.0 C B:SER166 3.7 36.5 1.0 CB B:PHE158 3.8 31.9 1.0 CG B:PHE158 3.8 38.5 1.0 CE2 B:PHE158 4.0 50.2 1.0 CB B:PHE165 4.0 34.9 1.0 N B:CYS167 4.0 32.5 1.0 N B:PHE158 4.4 26.4 1.0 N B:SER166 4.6 30.6 1.0 CD2 B:PHE165 4.7 62.7 1.0 CG B:PHE165 4.7 51.4 1.0 CA B:PHE158 4.7 26.1 1.0 CA B:SER166 4.8 38.5 1.0 C B:PHE165 4.9 39.2 1.0

A.Kuzin, Y.Chen, S.M.Vorobiev, J.Seetharaman, J.Janjua, R.Xiao, K.Cunningham, M.Maglaqui, L.A.Owens, H.Wang, J.K.Everett, T.B.Acton, G.T.Montelione, J.F.Hunt, L.Tong. Northeast Structural Genomics Consortium Target HSR50 To Be Published.