Magnesium in the structure of Crystal Structure of E. Coli Hppk(D95A) in Complex With Mgampcpp (pdb 3ilj)

The binding sites of Magnesium atom in the structure of Crystal Structure of E. Coli Hppk(D95A) in Complex With Mgampcpp (pdb code 3ilj). This binding sites where shown with 5.0 Angstroms radius around Magnesium atom. The 3ilj structure was solved by J.BLASZCZYK, Y.LI, H.YAN, X.JI, with X-Ray Crystallography technique, brief refinement statistics is given in the table below: Resolution (A) 29.3-1.6 Space group P21212 a (A) 53.030 b (A) 70.210 c (A) 36.260 alpha (°) 90.00 beta (°) 90.00 gamma (°) 90.00 Rfactor (%) 18.2 Rfree (%) 22.5 Magnesium Binding Sites: Magnesium binding site 1 out of 1 in 3ilj Click to enlarge Click to enlarge Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Magnesium in the PDB 3ilj. Coordination sphere was calculated for all residues within 5.0 Angstroms distance from the central Magnesium atom, shown by VdW sphere Residues shown as a stick model or VDW spheres: A: Leu96, A: Asp97, A: His115, A: Apc171, A: Hoh201, A: Hoh202, A: Hoh203, A: Hoh334, A: Hoh339, A: Hoh365, A: Hoh404, conact list: Atom Atom Distance (A) Mg O A:Leu96 4.72 Mg CB A:Asp97 4.51 Mg OD2 A:Asp97 3.46 Mg OD1 A:Asp97 2.21 Mg CG A:Asp97 3.17 Mg NE2 A:His115 4.13 Mg CD2 A:His115 4.88 Mg N3 A:Apc171 4.32 Mg PG A:Apc171 3.34 Mg O3B A:Apc171 4.99 Mg O3B A:Apc171 3.25 Mg O2G A:Apc171 4.29 Mg PA A:Apc171 3.86 Mg C2 A:Apc171 4.42 Mg C3A A:Apc171 3.79 Mg C3A A:Apc171 4.49 Mg C4 A:Apc171 4.99 Mg O5' A:Apc171 4.02 Mg O5' A:Apc171 4.66 Mg O2B A:Apc171 4.50 Mg O3G A:Apc171 4.44 Mg O1B A:Apc171 3.19 Mg O1B A:Apc171 2.34 Mg PB A:Apc171 4.13 Mg PB A:Apc171 3.37 Mg O4' A:Apc171 4.78 Mg O4' A:Apc171 4.72 Mg C5' A:Apc171 4.94 Mg C5' A:Apc171 4.72 Mg O1G A:Apc171 4.20 Mg O1G A:Apc171 2.35 Mg O1A A:Apc171 3.03 Mg O A:Hoh201 2.47 Mg O A:Hoh202 2.49 Mg O A:Hoh203 2.40 Mg O A:Hoh334 4.50 Mg O A:Hoh339 3.82 Mg O A:Hoh365 4.05 Mg O A:Hoh404 4.78 interactive model: