Mercury in PDB 1jjv: Dephospho-Coa Kinase in Complex with Atp

All present enzymatic activity of Dephospho-Coa Kinase in Complex with Atp:
2.7.1.24;

The structure of Dephospho-Coa Kinase in Complex with Atp, PDB code: 1jjv was solved by G.Obmolova, A.Teplyakov, N.Bonander, E.Eisenstein, A.J.Howard, G.L.Gilliland, Structure 2 Function Project (S2F), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	10.00 / 2.00
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	126.000, 45.900, 41.700, 90.00, 97.60, 90.00
R / Rfree (%)	16.5 / 21.8

The binding sites of Mercury atom in the Dephospho-Coa Kinase in Complex with Atp (pdb code 1jjv). 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 Dephospho-Coa Kinase in Complex with Atp, PDB code: 1jjv:

Mercury binding site 1 out of 1 in the Dephospho-Coa Kinase in Complex with Atp


Mono view


Stereo pair view

A full contact list of Mercury with other atoms in the Hg binding site number 1 of Dephospho-Coa Kinase in Complex with Atp within 5.0Å range: probe atom residue distance (Å) B Occ A:Hg302 b:34.0 occ:1.00 O A:HOH382 2.2 42.1 1.0 SG A:CYS124 2.3 24.9 1.0 O A:CYS124 2.9 26.1 1.0 O A:THR121 2.9 34.2 1.0 C A:CYS124 3.3 25.0 1.0 CB A:CYS124 3.3 28.2 1.0 CG1 A:ILE127 3.4 26.7 1.0 N A:ARG126 3.6 25.0 1.0 CA A:CYS124 3.7 30.7 1.0 C A:THR121 3.9 36.4 1.0 C A:ASP125 4.0 25.9 1.0 N A:CYS124 4.0 32.0 1.0 C A:ARG126 4.0 33.0 1.0 O A:ARG126 4.0 28.9 1.0 N A:ASP125 4.0 22.0 1.0 CD1 A:ILE127 4.0 23.0 1.0 O A:HOH408 4.1 45.7 1.0 CA A:ARG126 4.2 24.8 1.0 CA A:THR121 4.2 30.8 1.0 CA A:ASP125 4.4 21.1 1.0 O A:ASP125 4.5 26.1 1.0 CB A:THR121 4.5 28.8 1.0 N A:ILE127 4.5 22.1 1.0 CB A:ILE127 4.8 23.1 1.0 CA A:ILE127 4.9 16.4 1.0 O A:HOH384 5.0 42.8 1.0

G.Obmolova, A.Teplyakov, N.Bonander, E.Eisenstein, A.J.Howard, G.L.Gilliland. Crystal Structure of Dephospho-Coenzyme A Kinase From Haemophilus Influenzae. J.Struct.Biol. V. 136 119 2001.
ISSN: ISSN 1047-8477
PubMed: 11886213
DOI: 10.1006/JSBI.2001.4428