Table 3. Stability Constants (log β) and pKa Values of the Zn(II)/Peptide Systemsa.
peptide | species | log βb | pKac | deprotonating residue |
---|---|---|---|---|
P1 | [ZnH2L]− | 26.97(2) | ||
[ZnHL]2– | 21.06(2) | 5.91 | His | |
[ZnL]3– | 13.79(4) | 7.27 | Cys | |
[ZnLH–1]4– | 3.58(4) | 10.21 | Owater | |
P2 | [ZnH2L]3+ | 26.65(4) | ||
[ZnHL]2+ | 20.91(2) | 5.74 | His | |
[ZnL]+ | 13.16(6) | 7.75 | Cys | |
[ZnLH–1] | 3.51(6) | 9.65 | Owater | |
[ZnLH–2]− | –7.16(6) | 10.57 | Owater/Lys |
T = 298 K; I = 0.1 M NaClO4; standard deviations are given in parentheses.
Overall stability constants (β) expressed by the equation β([ZnHnL](n+2)+) = [[ZnHnL](n+2)+]/[Zn(II)][[L]n+][H+]n.
Acid dissociation constants (pKa) expressed as pKa = log β([ZnHnL](n+2)+) – log β([ZnHn–1L](n+1)+).