Low resolution Seglitide (LTQ)

Error Analysis
Convolution function
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ParameterValue
Peak tolerance0.200
Amino acids
a = 85.053
Y = 163.063
W = 186.079
K = 128.095
V = 99.068
F = 147.068
Offsets
-18.011
-17.027
+1.003
Filtering MethodPeak CountCutsExactTotal
Raw spectrum 472 24/30 38.62 58.51
Top 5 peaks in 50.00 window 53 22/30 59.10 73.58
DescriptionCuts0 -18.01 -17.03 1.00 Total
a . Y * W * K * V * F 4/5 11.38 6.22 0.00 0.00 17.59
Y . W * K * V * F * a 4/5 12.79 12.44 0.42 2.18 27.83
W . K * V . F * a * Y 3/5 6.89 1.36 0.84 0.00 9.10
K . V . F * a * Y * W 3/5 4.77 2.90 0.00 0.00 7.66
V . F * a * Y * W * K 4/5 14.78 0.00 2.11 0.42 17.32
F . a * Y * W * K * V 4/5 8.50 1.93 0.00 0.00 10.42
Normal Ions Summary 22/30 59.10 11.04 1.26 2.18 73.58
GPR Ions 7 5.92 0.00 0.00 0.00 5.92
Experimental Parent Mass808.5268
Theoretical Parent Mass808.4272
Mass Intensity Perc Int
332.224* 1026575.069.589 VFa YW[-18]
724.422* 659388.316.159 YWKVF
710.396* 611611.385.713 FaYWK
563.375* 597328.625.579 aYWK
577.394* 529319.944.944 YWKV
644.428 519719.914.855 aYWKV[-18]
752.442 515034.004.811
561.404 479702.164.481 WKVF
681.330* 417724.753.902 VFaYW
674.437 310330.842.899
460.339 305165.252.850 KVFa YWK[-18]
435.247* 289069.812.700 aYW
651.403 275259.842.571
662.410 273060.562.551 aYWKV
725.443 233169.882.178 YWKVF[+1]
692.396 206126.781.925 FaYWK[-18]
734.381 197942.311.849
680.417 187750.561.754
534.341 158169.521.477 aYWV
538.384 151624.551.416 YKVF
753.436 146936.561.372
396.309 146047.771.364 FaY WKV[-18]
545.382 145967.751.363 aYWK[-18]
315.247 143697.671.342 WK VFa[-17]
357.289 142780.171.334 KVF[-18]
582.354 125185.771.169 FaYW
623.392 121851.301.138 KVFaY
646.406 114607.991.071 WKVFa
442.392 109942.311.027 KVFa[-18]
596.390 103314.600.965 YWVF
527.384 100877.620.942
350.161 98087.030.916 YW
298.203 89692.670.838 WK[-17]
410.263 87437.380.817 YVF
416.496 87157.560.814
375.313 83429.190.779 KVF
499.408 83017.500.775 aWKV
478.371 82154.870.767 YWK VFaY[-17]
452.278 80885.030.756
495.253 75795.650.708 VFaY
488.333 75304.050.703
403.267 72699.380.679
591.388 66981.530.626
247.096 62687.640.586 VF
249.083 58448.360.546 aY
605.407 57273.750.535 KVFaY[-18]
333.305 45219.170.422 YW[-17] VFa[+1]
365.210 44018.900.411
462.326 37291.590.348 WKF
233.118 26727.620.250 Fa
283.314 19988.450.187
270.229 13834.420.129
272.250 12427.690.116 aW
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