Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLTKPLQGPPAPPGTPTPPPGGKDREAFEAEYRLGPLLGKGGFGTVFAGHRLTDRLQVAIKVIPRNRVLGWSPLSDSVTCPLEVALLWKVGAGGGHPGVIRLLDWFETQEGFMLVLERPLPAQDLFDYITEKGPLGEGPSRCFFGQVVAAIQHCHSRGVVHRDIKDENILID--LRRGCAKLIDFGSGALLHDE--PYTDFDGTRVYSPPEWISRHQYHALPATVWSLGILLYDMVCGDIPF--ERDQEIL----EAELHFP----AHVSPDCCALIRRCLAPKPSSRPSLEEILLDPWMQTPAEDVPLNPSKGGPAPLAWSLLP |
3HZT Chain:A ((6-263)) | -------------------------------YQRVKKLGSGAYGEVLLCKDKLTGAERAIKIIKKSSV---TTTSNSGALLDEVAVLKQLD----HPNIMKLYEFFEDKRNYYLVME-VYRGGELFDEIILRQKFSEVDAAVIMKQVLSGTTYLHKHNIVHRDLKPENLLLESKSRDALIKIVDFGLSA--HFEVG-------TAYYIAPE-VLRKKYDE-KCDVWSCGVILYILLCGYPPFGGQTDQEILKRVEKGKFSFDPPDWTQVSDEAKQLVKLMLTYEPSKRISAEEALNHPWI------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3HZT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -181000 for 1786 contacts (-101.3/contact) +
2D Compatibility (PS) -25104 + (NN) -12134 + (LL) 728
1D Compatibility (HY) -22000 + (ID) 4200
Total energy: -243710.0 ( -136.46 by residue)
QMean score : 0.440
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