Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MQNAVIYQPVQIEYLKKTSDLFSEQQLADSFVLIFHLKGNGYISIGTNTNPLQKKTLYVCPPNETFGFTPAADGHIDACIIRLLSYIKETGQDIFTPCTESELAKLKLMNVSHIENLAVRLQELAALWNESSQLSQLKCVIEVQSLIYDLFTASLSDQTDTHSAIEKTKHYIETHADTKITLAQLSQMAGISAKHYSESFKKWTGQSVTEFITKTRITKAKRLMAKSNCKLKEIAHQTGYQDEFYFSRIFKKYTGCSPTSYMKKRRKKIAAYGRGTMGHLIPLHHIPFAAALHPKWTSYYYQHYSTDIPVQLSAYRFNEKWEENLYTLSQAEPDVIVSMDSISPEEQDRLNRIA------EVMYLPSEESWRTHFLQTASFLKEESEAEKWLADYDQQTTAAK-KTLQHVQGLRFLFLRLHKQNFYLAHNRS-VREVFFGDLGFSSATTADTPSEQA-ISLENIANYQADCMMLFLFKEPETIA---YYQQLQQTEAWQNLSAVRDNRVYLLSLDPWNEYSACGHERIVQQTVSLLSGDCP |
| 2WI8 Chain:A ((82-274)) | -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GEKMEPNIEKILEMKPDVILASTKF-PEK--TLQKISTAGTTIPVSHISS--NWKENMMLLAQLTGKEKKAKKIIADYEQDLKETKTKINDKAKDSKALVIRIRQGNIYIYPEQVYFNSTLYGDLGLKAPNEVKAAKAQELISLEKLSEMNPDHIFV-QFSDDENADKPDALKDLEKNPIWKSLKAVKEDHVYVNSVDP------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2WI8.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -82729 for 1160 contacts (-71.3/contact) +
2D Compatibility (PS) -19146 + (NN) -4736 + (LL) 25408
1D Compatibility (HY) -12800 + (ID) 2550
Total energy: -96553.0 ( -83.24 by residue)
QMean score : 0.418
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