Manganese in the structure of Crystal Structure of PAE0151 From Pyrobaculum Aerophilum (pdb 2fe1)

The binding sites of Manganese atom in the structure of Crystal Structure of PAE0151 From Pyrobaculum Aerophilum (pdb code 2fe1). This binding sites where shown with 5.0 Angstroms radius around Manganese atom. The 2fe1 structure was solved by R.D.BUNKER, E.N.BAKER, V.L.ARCUS, with X-Ray Crystallography technique, brief refinement statistics is given in the table below: Resolution (A) 52.6-2.2 Space group P6122 a (A) 72.343 b (A) 72.343 c (A) 96.803 alpha (°) 90.00 beta (°) 90.00 gamma (°) 120.00 Rfactor (%) 17.4 Rfree (%) 22.9 Manganese Binding Sites: Manganese binding site 1 out of 1 in 2fe1 Click to enlarge Click to enlarge Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Manganese in the PDB 2fe1. 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: Asp100, A: Asp118, A: Hoh323, A: Hoh334, A: Hoh370, A: Hoh377, A: Hoh378, conact list: Atom Atom Distance (A) Mn OD2 A:Asp100 4.63 Mn OD1 A:Asp100 4.60 Mn CB A:Asp118 4.16 Mn OD2 A:Asp118 2.24 Mn OD1 A:Asp118 4.40 Mn CG A:Asp118 3.45 Mn O A:Hoh323 2.36 Mn O A:Hoh334 4.36 Mn O A:Hoh370 2.53 Mn O A:Hoh377 2.97 Mn O A:Hoh378 3.94 interactive model: