Table 3.
peptide | Q1 m/z | Q3 m/z | default CV | default CV | default CV | AUC def −2 V | AUC default | AUC def +2 V | AUC def +2 V | AUC def +6 V | max AUC | best CV | % AUC gain at best CV |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TPHPALTEAK | 355.53 | 448.24 | 36 | 1575.0 | 2621.0 | 3605.1 | 3764.7 | 3552.3 | 3775.7 | 3480.7 | 3775.7 | Default +4 V | 0.3 |
TPHPALTEAK | 355.53 | 561.32 | 36 | 1359.2 | 1609.6 | 1922.3 | 1702.8 | 1630.8 | 1892.5 | 1481.6 | 1922.3 | Default −2 V | 12.9 |
TPHPALTEAK | 355.53 | 729.41 | 36 | 4328.5 | 5235.2 | 5102.2 | 5014.6 | 4653.8 | 4927.4 | 3742.2 | 5235.2 | Default −4 V | 4.4 |
WC[160]TISTHEANK | 449.54 | 461.24 | 36 | 1109.8 | 1010.4 | 1145.1 | 1115.9 | 991.5 | 822.2 | 635.9 | 1145.1 | Default −2 V | 2.6 |
WC[160]TISTHEANK | 449.54 | 598.30 | 36 | 791.0 | 507.6 | 545.3 | 814.5 | 828.1 | 405.2 | 471.4 | 828.1 | Default +2 V | 1.7 |
WC[160]TISTHEANK | 449.54 | 786.37 | 36 | 1037.7 | 1472.7 | 1726.9 | 2283.3 | 1313.4 | 1529.4 | 806.8 | 2283.3 | Default | 0.0 |
AVVQDPALKPLALVYGEATSR | 733.41 | 434.24 | 36 | 7249.9 | 7305.5 | 8052.4 | 8030.0 | 8136.8 | 5980.1 | 7246.1 | 8136.8 | Default +2 V | 1.3 |
AVVQDPALKPLALVYGEATSR | 733.41 | 563.28 | 36 | 5310.8 | 5920.4 | 5729.5 | 5378.3 | 6143.5 | 5195.3 | 4956.1 | 6143.5 | Default +2 V | 14.2 |
AVVQDPALKPLALVYGEATSR | 733.41 | 620.30 | 36 | 23479.0 | 26911.3 | 24702.9 | 27168.1 | 26404.7 | 22470.2 | 24323.1 | 27168.1 | Default | 0.0 |
AVVQDPALKPLALVYGEATSR | 733.41 | 783.36 | 36 | 27002.5 | 27145.7 | 24043.7 | 26749.6 | 25157.1 | 23732.7 | 23591.2 | 27145.7 | Default −4 V | 1.5 |
AVVQDPALKPLALVYGEATSR | 733.41 | 882.44 | 36 | 6775.5 | 7654.5 | 7950.4 | 7954.0 | 7068.5 | 6519.1 | 5395.6 | 7954.0 | Default | 0.0 |
The AUC calculations were performed by the MRM software package Mr. M, and the CV that produced the largest AUC was taken to be the best-performing CV for the given transition. The percent gain in AUC represents the increase in AUC for the best-performing CV relative to the default CV.