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

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 A) (pdb code 1uvo). This binding sites where shown with 5.0 Angstroms radius around Cadmium atom. The 1uvo 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) 50.000 b (A) 57.850 c (A) 74.300 alpha (°) 90.00 beta (°) 90.00 gamma (°) 90.00 Rfactor (%) 16.5 Rfree (%) 20.5 Cadmium Binding Sites: Cadmium binding site 1 out of 1 in 1uvo Click to enlarge Click to enlarge Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Cadmium in the PDB 1uvo. 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: Hoh2065, A: Hoh2074, A: Hoh2085, conact list: Atom Atom Distance (A) Cd OE1 A:Glu59 2.22 Cd OE2 A:Glu59 3.11 Cd CD A:Glu59 2.98 Cd CG A:Glu59 4.42 Cd CA A:Glu59 4.95 Cd N A:His60 4.40 Cd C A:His60 4.92 Cd O A:Asn61 2.29 Cd N A:Asn61 3.86 Cd CB A:Asn61 4.46 Cd C A:Asn61 3.41 Cd CA A:Asn61 4.13 Cd O A:Leu62 4.91 Cd N A:Leu62 4.42 Cd C A:Leu62 4.69 Cd CA A:Leu62 4.56 Cd O A:Gln64 2.43 Cd N A:Gln64 4.42 Cd C A:Gln64 3.65 Cd CA A:Gln64 4.63 Cd N A:Asn65 4.43 Cd C A:Asn65 4.32 Cd CA A:Asn65 4.32 Cd N A:Asp66 3.71 Cd CB A:Asp66 3.90 Cd OD2 A:Asp66 2.27 Cd OD1 A:Asp66 4.17 Cd CG A:Asp66 3.26 Cd CA A:Asp66 4.43 Cd OE1 A:Glu69 4.33 Cd OE2 A:Glu69 2.17 Cd CD A:Glu69 3.25 Cd CG A:Glu69 3.71 Cd O A:Hoh2065 2.14 Cd O A:Hoh2074 4.75 Cd O A:Hoh2085 4.51 interactive model: