Cadmium in PDB 8a4g: Ipns H270E Variant in Complex with Cd and Acv

All present enzymatic activity of Ipns H270E Variant in Complex with Cd and Acv:
1.21.3.1;

The structure of Ipns H270E Variant in Complex with Cd and Acv, PDB code: 8a4g was solved by P.Rabe, C.J.Schofield, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	41.80 / 1.97
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	41.08, 74.07, 101.27, 90, 90, 90
R / Rfree (%)	21.7 / 25.4

The structure of Ipns H270E Variant in Complex with Cd and Acv also contains other interesting chemical elements:

Chlorine

(Cl)

1 atom

The binding sites of Cadmium atom in the Ipns H270E Variant in Complex with Cd and Acv (pdb code 8a4g). This binding sites where shown within 5.0 Angstroms radius around Cadmium atom.
In total only one binding site of Cadmium was determined in the Ipns H270E Variant in Complex with Cd and Acv, PDB code: 8a4g:

Cadmium binding site 1 out of 1 in the Ipns H270E Variant in Complex with Cd and Acv


Mono view


Stereo pair view

A full contact list of Cadmium with other atoms in the Cd binding site number 1 of Ipns H270E Variant in Complex with Cd and Acv within 5.0Å range: probe atom residue distance (Å) B Occ A:Cd402 b:33.2 occ:0.95 NE2 A:HIS214 2.6 27.4 1.0 OD1 A:ASP216 2.6 30.3 1.0 OE1 A:GLU270 2.8 28.8 1.0 S17 A:ACV407 2.8 30.3 1.0 CD A:GLU270 3.0 29.4 1.0 CG A:ASP216 3.3 28.8 1.0 HG3 A:GLU270 3.3 30.6 1.0 OE2 A:GLU270 3.3 30.4 1.0 CD2 A:HIS214 3.4 28.0 1.0 OD2 A:ASP216 3.4 25.5 1.0 HD2 A:HIS214 3.5 33.6 1.0 C16 A:ACV407 3.5 30.8 1.0 CE1 A:HIS214 3.5 28.8 1.0 CG A:GLU270 3.7 25.5 1.0 HE1 A:HIS214 3.7 34.6 1.0 O A:HOH635 3.8 25.6 1.0 C37 A:ACV407 3.9 30.7 1.0 C33 A:ACV407 4.0 32.0 1.0 HG2 A:GLU270 4.1 30.6 1.0 HA A:ASP216 4.3 30.8 1.0 CB A:ASP216 4.5 26.5 1.0 HE1 A:PHE285 4.5 36.0 1.0 CG A:HIS214 4.6 27.5 1.0 C32 A:ACV407 4.6 31.0 1.0 ND1 A:HIS214 4.6 29.7 1.0 N29 A:ACV407 4.8 29.7 1.0 CA A:ASP216 4.8 25.7 1.0 HB3 A:ASP216 4.8 31.8 1.0 C12 A:ACV407 4.8 32.2 1.0 HB2 A:GLU270 4.9 26.1 1.0 O A:HOH651 4.9 30.8 1.0 HG21 A:THR221 4.9 26.7 1.0 CB A:GLU270 4.9 21.7 1.0 C13 A:ACV407 5.0 31.5 1.0

P.Rabe, C.J.Schofield. Ipns H270E Variant in Complex with Cd and Acv To Be Published.