From: Conformational preference of ChaK1 binding peptides: a molecular dynamics study
Lys2 | Arg5 | Ile6 | Lys9 | Ser10 | Ile11 | Phe12 | Arg13 | ATP | |
---|---|---|---|---|---|---|---|---|---|
Gly1618 | 0.80(100%) | ||||||||
Gly1620 | 0.89(68.1%) | 0.94(76.8%) | 0.97(59.4%) | 0.66(100%) | |||||
Leu1621 | 0.89(68.6%) | 0.69(100%) | 0.73(99.6%) | 0.90(78.7%) | 0.81(100%) | ||||
Arg1622 | 0.68(100%) | ||||||||
Lys1646 | 0.76(100%) | ||||||||
Leu1649 | 0.85(70.6%) | 0.87(97.5%) | |||||||
Glu1651 | 0.95(72.8%) | 0.76(93.0%) | 0.67(100%) | ||||||
Val1652 | 0.72(99.4%) | 1.0(48.5%) | 0.91(74%) | ||||||
Gly1655 | 0.82(91.7%) | 1.0(54.4%) | 0.95(59.2%) | ||||||
Glu1718 | 0.91(100%) | ||||||||
Lys1727 | 0.84(80.7%) | 0.90(99.9%) | |||||||
Asn1731 | 1.0(57.5%) | 0.77(98.4%) | 0.73(92.1%) | ||||||
Asn1732 | 0.96(67.9%) | 0.92(73.1%) | 0.90(82.1%) | 0.98(64.1%) | 0.74(100%) | ||||
Asp1734 | 0.93(64.7%) | 0.95(65.7%) | |||||||
Asp1765 | 0.97(70.9%) | ||||||||
Asn1795 | 0.67(97.3%) | 0.74(95.4%) | |||||||
Asp1799 | 0.92(70.7%) | 0.77(99.4%) | 0.6(100%) | ||||||
Ala1800 | 0.89(83.5%) | 0.81(87.5%) | 0.78(92.9%) | 0.90(97.0%) |