Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MEHKEIVIGVDIGSRKICAIVAEF-KDGILRIIGTAHQDSKEINSKAIKRGRINSLAHASNAIKEVINSAKKMAGLNADEDRNNPISSFRESYHPKTKAIVSFSG--AYTESIRDVTGVASTK---DNVVTIDEINRAINNACAKAGLDNDKHILHALPYRFTLDKQE-VNDPLGMSGT-RLEVFIHIVYTEKNNIENLEKIMIQSGVEIENIVINSYAASIATLSNDERELGVACVDMGGETCNLTIYSGNSIRYNKYLPVGSHHLTTDLSHMLNTPFPYAEEVKIKYGDLSFESGAETPSQSVQIPTTGSDGHESHIVPLSEIQTIMRERALETFKIIHRSIQDSGFEEHLGGGVVLTGGMALMKGIKELARTHFTNYPVRLATPVEKYNIMGMFEDLKDPRFSVVVGLILYKAGGHTNYERDSKGIIRYHESDDYIRKAHQSNPTPHIHSSPTERNLSDLKTPSAPLNTAKNDDFLPIKPTEQKGFFQNLLDKISKIF |
3WQT Chain:A ((20-390)) | ----HYYVSIDIGSSSVKTIVGEKFH-NGINVIGTGQTY-----TSGIKNGLIDDFDIARQAIKDTIKKASIASGVDI------------------KEVFLKLPIIGTEVYDES----N-EIDFYEDTEINGSHIEKVLEGIRE-----QETEVINVFPIRFIVDKENEVSDPKELIARHSLKVEAGVIAIQKSILINMIKCVEACGVDVLDVYSDAYNYGSILT-ATEKELGACVIDIGEDVTQVAFYERGELVDADSIEMAGRDITDDIAQGLNTSYETAEKVKHQYGHAFYDSA--SDQDIFTVEQVD--SDETVQYTQKDLSDFIEARVEEIFFEVFDVLQDLGLT-KVNGGFIVTGGSANLLGVKELLSDMV-SEKVRIHTPSQMG--------IRKPEFSSAISTISSSIAFDELLD------------------------------------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3WQT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -248936 for 3132 contacts (-79.5/contact) +
2D Compatibility (PS) -39184 + (NN) -13724 + (LL) 4836
1D Compatibility (HY) -17600 + (ID) 4150
Total energy: -318758.0 ( -101.77 by residue)
QMean score : 0.523
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