Structure and conformation of linear peptides

Abstract
The crystal structure of L-tyrosyl-L-tyrosine was determined. The molecule exists as a zwitterion, the peptide unit is trans planar, and the backbone torsion angles correspond to an extended conformation, with .psi.1 = 149.4.degree., .vphi.2 = -161.2.degree., .psi.2 = 158.3.degree.. The values of the side-chain torsion angles (.chi.1, .chi.2) are (-58.8.degree., -63.1.degree.) for the first tyrosine (-171.7.degree., -116.5.degree.) for the second. The planes of the aromatic rings are nearly parallel (dihedral angle of 6.1.degree.), and their centers are separated by 10.9 .ANG.. The carboxyl plane forms a dihedral angle of 23.8.degree. with the plane of the peptide bond.

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