Cadmium in the structure of Structure Of the Complex of Porcine Pancreatic Elastase in Complex With Cadmium Refined At 1.85 A Resolution (Crystal B) (pdb 1uvp)

The binding sites of Cadmium atom in the structure of Structure Of the Complex of Porcine Pancreatic Elastase in Complex With Cadmium Refined At 1.85 A Resolution (Crystal B) (pdb code 1uvp). This binding sites where shown with 5.0 Angstroms radius around Cadmium atom. The 1uvp structure was solved by M.S.WEISS, S.PANJIKAR, C.MUELLER-DIECKMANN, P.A.TUCKER, with X-Ray Crystallography technique, brief refinement statistics is given in the table below: Resolution (A) 20.0-1.9 Space group P212121 a (A) 49.750 b (A) 57.420 c (A) 74.030 alpha (°) 90.00 beta (°) 90.00 gamma (°) 90.00 Rfactor (%) 16.6 Rfree (%) 20.5 Cadmium Binding Sites: Cadmium binding site 1 out of 1 in 1uvp Click to enlarge Click to enlarge Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Cadmium in the PDB 1uvp. Coordination sphere was calculated for all residues within 5.0 Angstroms distance from the central Cadmium atom, shown by VdW sphere Residues shown as a stick model or VDW spheres: A: Glu59, A: His60, A: Asn61, A: Leu62, A: Gln64, A: Asn65, A: Asp66, A: Glu69, A: Hoh2070, A: Hoh2082, conact list: Atom Atom Distance (A) Cd OE1 A:Glu59 2.25 Cd OE2 A:Glu59 3.21 Cd CD A:Glu59 3.05 Cd CG A:Glu59 4.47 Cd CA A:Glu59 4.99 Cd N A:His60 4.44 Cd C A:His60 4.93 Cd O A:Asn61 2.29 Cd N A:Asn61 3.87 Cd CB A:Asn61 4.51 Cd C A:Asn61 3.42 Cd CA A:Asn61 4.13 Cd N A:Leu62 4.44 Cd C A:Leu62 4.72 Cd CA A:Leu62 4.57 Cd O A:Gln64 2.42 Cd N A:Gln64 4.43 Cd C A:Gln64 3.63 Cd CA A:Gln64 4.61 Cd N A:Asn65 4.45 Cd C A:Asn65 4.36 Cd CA A:Asn65 4.35 Cd N A:Asp66 3.75 Cd CB A:Asp66 3.98 Cd OD2 A:Asp66 2.30 Cd OD1 A:Asp66 4.18 Cd CG A:Asp66 3.30 Cd CA A:Asp66 4.48 Cd OE1 A:Glu69 4.33 Cd OE2 A:Glu69 2.24 Cd CD A:Glu69 3.30 Cd CG A:Glu69 3.80 Cd O A:Hoh2070 2.24 Cd O A:Hoh2082 4.47 interactive model: