Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | VAESFVRLEHVFYKYEDTEKYAVKDVSISAQKGEWVALVGHNGSGKSTIAKLLNGLLFPEDGLIKI-GH-FVLSEKNIWEIRRQVGMVFQNPDNQFVGATVQDDVAFGLENHGVP-------------HDTMVERVESALNEVGMQSYALHEPARLSGGQKQRVAIAGVLALQPDVIILDEATSMLDPRGRAEVMETIRIMREQEDITVISITHDLDEVLFADRVIVMNKGEIHSEGTPKEIFQQADAMREIGLGVPFIIELQEKLVAGGFETGSTVLSEGALLDQLWKLNSNN |
3B5J Chain:A ((4-233)) | -----ITFRNIRFRYKPDSPVILDNINLSIKQGEVIGIVGRAGSGKSTLTKLIQRFYIPENGQVLIDGHDLALADPN-W-LRRQVGVVLQ--DNVLLNRSIIDNIS--LANPGMSVEKVIYAAKLAGAHDFISELREGYNTIVGEQG------AGLSGGQRQRIAIARALVNNPKILIFDEATSALDYESEHVIMRNMHKICKGR--TVIIIAHRLSTVKNADRIIVMEKGKIVEQGKHKELLSEPESL--------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3B5J.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -106211 for 1589 contacts (-66.8/contact) +
2D Compatibility (PS) -22132 + (NN) 1522 + (LL) 3964
1D Compatibility (HY) -20000 + (ID) 4200
Total energy: -147057.0 ( -92.55 by residue)
QMean score : 0.469
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