Table 1.
Interaction | Approximate Frequency per 100 Residues | Approximate Energy (kcal/mol)a |
---|---|---|
n→π* Interactions | 3357 | 0.2569 |
C–H···O Hydrogen bonds | 1031 | 0–141,42 |
π–π Interactionsb | 5111 | 0.5–1.5117–119 |
C5 Hydrogen bonds | 583 | 0.25–1.583 |
Cation–π interactions | 1–294 | 0.5–285 |
Sulfur–arene interactionsb | 2–3130 | 0.3–0.5133,134 |
Anion–π interactions | 1–2125 | 0.5124 |
Chalcogen bonds | <1140 | 0.64140 |
X–H∙∙∙π Interactions | 1102 | 0.35143 |
Preference is given to experimental measurements in proteins and peptides. Computational values are used in the absence of experimental data.
Frequency per 100 residues was estimated by multiplying the frequency of relevant residues95 by the fraction of those residues that engage in the interaction.