Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MGLCGCIRGKPMTQETVGFAALGIHPNVLAAIVAVGYEEPSPIQAQSIPLIL--EGHDMIGQAQTGTGKTAAFALPLLSRIDPSRREPQMLV----LVPTRELALQVATACETYSKQLPGV---GVVAVYGGAPMGPQLKALRQ-GAQILVATPGRLCDHLRR-DEKLLATVQRLVLDEADEMLKLGFMDDLEVIFEALPESR-------QTVLFSATLPASIRGIAERHLKQPK--HVKIAAKTQTVA--RIEQVHLMVHADQKAGSI--------QRLLEVEQFDALIAFVRTKQATLDYAELLERQGYR---AAALNGDMPQAQRERVIESLKDGSLDIVIATDVAARGLDVPRITHVLNIDMPYDPESYVHRIGRTGRAGREGRALLLVTPRERRMLQVIERVTGQKVGEVRLPDAETVLEARLARLAASLTPLLDSAVEQRGAVRDELCRRLGCDAETLAAALLARLTAGKALDLESVRREQPLTPSAPRERADRGERGERPERSGERRPMAPPSEGRARCRTALGARDGVAAKNLLGAILNEGGLSREDIGRIQIRDTFSLIELPEANLERLLTKLKDTRVAGKALRLRRYRED |
3I5X Chain:A ((86-450)) | ------------------------------AITRMEFPGLTPVQQKTIKPILSSEDHDVIARAKTGTGKTFAFLIPIFQHLINTKFDSQYMVKAVIVAPTRDLALQIEAEVKKIHDMNYGLKKYACVSLVGGTDFRAAMNKMNKLRPNIVIATPGRLIDVLEKYSNKFFRFVDYKVLDEADRLLEIGFRDDLETISGILNEKNSKSADNIKTLLFSATLDDKVQKLANNIMNKKECLFLDTVDKNEPEAHERIDQS--VVISEKFANSIFAAVEHIKKQIKERDSNYKAIIFAPTVKFTSFLCSILKNEFKKDLPILEFHGKITQNKRTSLVKRFKKDESGILVCTDVGARGMDFPNVHEVLQIGVPSELANYIHRIGRTARSGKEGSSVLFICKDE----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3I5X.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -178565 for 2660 contacts (-67.1/contact) +
2D Compatibility (PS) -35534 + (NN) -10037 + (LL) 16560
1D Compatibility (HY) -28000 + (ID) 5700
Total energy: -241276.0 ( -90.71 by residue)
QMean score : 0.489
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