Copper in PDB 6r1l: Crystal Structure of Lmrr with Bound Copper Phenanthroline

The structure of Crystal Structure of Lmrr with Bound Copper Phenanthroline, PDB code: 6r1l was solved by R.Reddem, A.M.W.H.Thunnissen, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	34.20 / 2.10
Space group	P 43 21 2
Cell size a, b, c (Å), α, β, γ (°)	34.851, 34.851, 177.469, 90.00, 90.00, 90.00
R / Rfree (%)	20.1 / 24.8

The binding sites of Copper atom in the Crystal Structure of Lmrr with Bound Copper Phenanthroline (pdb code 6r1l). This binding sites where shown within 5.0 Angstroms radius around Copper atom.
In total only one binding site of Copper was determined in the Crystal Structure of Lmrr with Bound Copper Phenanthroline, PDB code: 6r1l:

Copper binding site 1 out of 1 in the Crystal Structure of Lmrr with Bound Copper Phenanthroline


Mono view


Stereo pair view

A full contact list of Copper with other atoms in the Cu binding site number 1 of Crystal Structure of Lmrr with Bound Copper Phenanthroline within 5.0Å range: probe atom residue distance (Å) B Occ A:Cu202 b:95.1 occ:0.50 N10 A:PHN201 2.0 70.3 0.5 N1 A:PHN201 2.0 70.2 0.5 O A:HOH306 2.0 67.7 1.0 C10 A:PHN201 2.8 68.1 0.5 C1A A:PHN201 2.8 68.1 0.5 C9 A:PHN201 3.1 68.5 0.5 C2 A:PHN201 3.1 68.6 0.5 O A:HOH312 3.3 60.3 1.0 CE3 A:TRP96 4.0 56.2 1.0 C6A A:PHN201 4.1 67.9 0.5 C4A A:PHN201 4.1 67.9 0.5 CD2 A:TRP96 4.4 57.2 1.0 C8 A:PHN201 4.4 66.7 0.5 C3 A:PHN201 4.4 66.7 0.5 CZ3 A:TRP96 4.5 55.0 1.0 OD1 A:ASP100 4.6 69.2 1.0 CG A:TRP96 4.7 54.5 1.0 C7 A:PHN201 4.8 68.6 0.5 C4 A:PHN201 4.8 68.7 0.5 CB A:TRP96 4.8 50.6 1.0

L.Villarino, S.Chordia, L.Alonso-Cotchico, E.R.Reddem, A.M.W.H.Thunnissen, J.D.Marechal, G.Roelfes. Catalytic Promiscuity in An Artificial Metalloenzyme Involving Dynamic Positioning of the Metal Cofactor To Be Published.