Aluminium in the structure of Crystal Structure of the CDC42/CDC42GAP/ALF3 Complex. (pdb 1grn)

The binding sites of Aluminium atom in the structure of Crystal Structure of the CDC42/CDC42GAP/ALF3 Complex. (pdb code 1grn). This binding sites where shown with 5.0 Angstroms radius around Aluminium atom. The 1grn structure was solved by N.NASSAR, G.R.HOFFMAN, J.C.CLARDY, R.A.CERIONE, with X-Ray Crystallography technique, brief refinement statistics is given in the table below: Resolution (A) 30.0-2.1 Space group P212121 a (A) 52.400 b (A) 69.000 c (A) 129.600 alpha (°) 90.00 beta (°) 90.00 gamma (°) 90.00 Rfactor (%) 21.1 Rfree (%) 25.9 Aluminium Binding Sites: Aluminium binding site 1 out of 1 in 1grn Click to enlarge Click to enlarge Mono- and Stereo- picture of 5.0 Angstrom coordination sphere 1 of Aluminium in the PDB 1grn. Coordination sphere was calculated for all residues within 5.0 Angstroms distance from the central Aluminium atom, shown by VdW sphere Residues shown as a stick model or VDW spheres: A: Gly12, A: Ala13, A: Lys16, A: Pro34, A: Thr35, A: Thr58, A: Ala59, A: Gly60, A: Gln61, B: Arg305, A: Mg199, A: Gdp198, A: Af3200, A: Hoh526, A: Hoh527, A: Hoh545, conact list: Atom Atom Distance (A) Al N A:Gly12 4.91 Al C A:Gly12 4.42 Al CA A:Gly12 3.80 Al N A:Ala13 3.91 Al CE A:Lys16 4.62 Al NZ A:Lys16 4.01 Al CB A:Pro34 4.39 Al C A:Pro34 4.58 Al CA A:Pro34 4.17 Al O A:Thr35 4.56 Al N A:Thr35 3.91 Al CB A:Thr35 4.85 Al CA A:Thr35 4.86 Al O A:Thr58 4.67 Al C A:Ala59 5.00 Al CA A:Ala59 4.74 Al N A:Gly60 4.16 Al CA A:Gly60 4.99 Al NE2 A:Gln61 3.82 Al OE1 A:Gln61 4.06 Al CD A:Gln61 4.38 Al CZ B:Arg305 4.40 Al NE B:Arg305 4.06 Al NH2 B:Arg305 3.76 Al MG A:Mg199 3.62 Al O3B A:Gdp198 2.21 Al O1B A:Gdp198 3.90 Al PB A:Gdp198 3.36 Al O2B A:Gdp198 3.61 Al O3A A:Gdp198 4.62 Al F3 A:Af3200 1.84 Al F2 A:Af3200 1.86 Al AL A:Af3200 0.00 Al F1 A:Af3200 1.87 Al O A:Hoh526 2.26 Al O A:Hoh527 4.10 Al O A:Hoh545 4.46 interactive model: