Manganese in the structure of The Covalent And Three-Dimensional Structure of Concanavalin A, IV.Atomic Coordinates,Hydrogen Bonding,and Quaternary Structure (pdb 2cna)

The binding sites of Manganese atom in the structure of The Covalent And Three-Dimensional Structure of Concanavalin A, IV.Atomic Coordinates,Hydrogen Bonding,and Quaternary Structure (pdb code 2cna). This binding sites where shown with 5.0 Angstroms radius around Manganese atom. The 2cna structure was solved by G.N.REEKEJUNIOR, J.W.BECKER, G.M.EDELMAN, with X-Ray Crystallography technique, brief refinement statistics is given in the table below: Resolution (A) 2.0 Space group I222 a (A) 89.910 b (A) 87.230 c (A) 63.070 alpha (°) 90.00 beta (°) 90.00 gamma (°) 90.00 Rfactor (%) n/a Rfree (%) n/a Manganese Binding Sites: Manganese binding site 1 out of 1 in 2cna Click to enlarge Click to enlarge Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Manganese in the PDB 2cna. Coordination sphere was calculated for all residues within 5.0 Angstroms distance from the central Manganese atom, shown by VdW sphere Residues shown as a stick model or VDW spheres: A: Glu8, A: Asp10, A: Asp19, A: His24, A: Val32, A: Ser34, A: Ca239, A: Hoh240, A: Hoh241, A: Hoh242, conact list: Atom Atom Distance (A) Mn OE1 A:Glu8 3.64 Mn OE2 A:Glu8 2.88 Mn CD A:Glu8 3.58 Mn CB A:Asp10 3.93 Mn OD2 A:Asp10 2.94 Mn OD1 A:Asp10 4.67 Mn CG A:Asp10 3.70 Mn CB A:Asp19 3.66 Mn OD2 A:Asp19 2.67 Mn OD1 A:Asp19 3.99 Mn CG A:Asp19 3.26 Mn CA A:Asp19 4.52 Mn NE2 A:His24 2.44 Mn ND1 A:His24 4.54 Mn CD2 A:His24 3.30 Mn CE1 A:His24 3.45 Mn CG A:His24 4.50 Mn O A:Val32 4.98 Mn OG A:Ser34 3.79 Mn CA A:Ca239 4.56 Mn O A:Hoh240 2.53 Mn O A:Hoh241 2.55 Mn O A:Hoh242 4.09 interactive model: