Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTRYKAQISYDGSAFSGFQRQPNCRTVQEEIERTLKRLNSGND-----VIIHGAGRTDAGVHAYGQVIH---------FDLPQARDVEKLRFGLDTQCPDDID-------------IVKVEQVSDDFHCRYDK--HIKTYEFLVDIGRPKNPMMRN-----YATHYPYPVIIELM-QEAIKDLVGTHDFTGFTASG---TSVENKVRTIFDAKIQFEASKNLLIFTFTGNGFLYKQVRNMVGTLLKIGNGR----MPISQIKTILQ--------AKNRDLAGPTAAGNGLYLKEIIYEDKECFSNFRK-------- |
1E19 Chain:A ((2-314)) | --GKRVVIALGGNALQQRGQKGSYEEMMDNVRKTARQIAEIIARGYEVVITHGNGPQVGSLLLHMDAGQATYGIPAQPMDVAGAMSQGWIGYMIQQALKNELRKRGMEKKVVTIITQTIVDKNDPAFQNPTKPVGPFYDEETAKRLAREKGWIVKEDSGRGWRRVVPSPDPKGHVEAETIKKLVERGVIVIASGGGGVPVILEDGEIKGVEAVIDKDLAGEKLAEEVNADIFMILTDVNGAALYYGTEKEQWLREVKVEELRKYYEEGHFKAGSMGPKVLAAIRFIEWG-GERAIIAHLEKAVEALEGKTGTQVLP |
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General information:
TITO was launched using:
| RESULT:
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Template: 1E19.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -19235 for 1939 contacts (-9.9/contact) +
2D Compatibility (PS) -26639 + (NN) -658 + (LL) 436
1D Compatibility (HY) -5200 + (ID) 1750
Total energy: -53046.0 ( -27.36 by residue)
QMean score : 0.083
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