Protein Structure from Scientific Research

Optimized structures of 8ChB 3 complexes with Cl (red) or Cu(I) (blue) overlapped (left), along with the NBO * CtrzTe orbitals (pink and light blue, centre) and the NBO n Te orbitals (yellow and green, right), drawn at the 0.03 e Bohr -3 contour. In b and c , the intermolecular interactions are represented as dashed lines, regardless of their nature.

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