Molybdenum in the structure of Trimethylamine N-Oxide Reductase From Shewanella Massilia (pdb 1tmo)

The binding sites of Molybdenum atom in the structure of Trimethylamine N-Oxide Reductase From Shewanella Massilia (pdb code 1tmo). This binding sites where shown with 5.0 Angstroms radius around Molybdenum atom. The 1tmo structure was solved by M.CZJZEK, J.P.DOS SANTOS, G.GIORDANO, V.MEJEAN, with X-Ray Crystallography technique, brief refinement statistics is given in the table below: Resolution (A) 20.0-2.5 Space group P21212 a (A) 123.320 b (A) 140.700 c (A) 59.390 alpha (°) 90.00 beta (°) 90.00 gamma (°) 90.00 Rfactor (%) 18.2 Rfree (%) 24.7 Molybdenum Binding Sites: Molybdenum binding site 1 out of 1 in 1tmo Click to enlarge Click to enlarge Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Molybdenum in the PDB 1tmo. Coordination sphere was calculated for all residues within 5.0 Angstroms distance from the central Molybdenum atom, shown by VdW sphere Residues shown as a stick model or VDW spheres: A: Trp118, A: Ser149, A: His651, A: His657, A: 2md799, A: 2md800, A: 2mo801, A: Hoh1305, conact list: Atom Atom Distance (A) Mo NE1 A:Trp118 4.18 Mo N A:Ser149 4.41 Mo CB A:Ser149 3.01 Mo OG A:Ser149 1.73 Mo CA A:Ser149 4.13 Mo CE1 A:His651 4.84 Mo NE2 A:His657 4.72 Mo CE1 A:His657 4.83 Mo S13 A:2md799 2.54 Mo C13 A:2md799 3.66 Mo C12 A:2md799 3.70 Mo S12 A:2md799 2.59 Mo S13 A:2md800 2.69 Mo C13 A:2md800 3.69 Mo C12 A:2md800 3.73 Mo S12 A:2md800 2.80 Mo MO A:2mo801 0.00 Mo OT1 A:2mo801 1.64 Mo OT2 A:2mo801 1.57 Mo O A:Hoh1305 4.15 interactive model: