Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | LQDLTLFLEQYKKVIDESLFKEINERNIEP-RLKESMLYSIQAGGKRIRPMLVFATLQALKVNPLLGVKTATALEMIHTYSLIHDDLPAMDNDDYRRGKWTNHKVFGDATAILAGDALLTLAFSILAEDDNLSFETRIA-LINQISFSSGAEGMVGGQLADLEAEN-KQVTLEELSSIHARKTGELLIYAVTSAAKIAEADPEQTKRLRIFAENIGIGFQISDDILDVIGDETKMGKKTGADAFLNKSTYPGLLTLDGAKR---ALNEHVTIAKSALSGHDFDDEILLKLADLIALREN |
3OAB Chain:A ((27-295)) | ----------------------------EPLKIHESMRYSLLAGGKRVRPMLCIAACELVGGDESTAMPAACAVEMIHTMSLMHDDLPCMDNDDLRRGKPTNHMAFGESVAVLAGDALLSFAFEHVAAATKGAPPERIVRVLGELAVSIGSEGLVAGQVVDVCSEGMAEVGLDHLEFIHHHKTAALLQGSVVLGAILGGGKEEEVAKLRKFANCIGLLFQVVDDILDVTK----------------KTTYPKLIGVEKSKEFADRLNREAQ--EQLLHFHPHRAAPLIALANYIAYRDN |
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General information:
TITO was launched using:
| RESULT:
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Template: 3OAB.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -91855 for 1997 contacts (-46.0/contact) +
2D Compatibility (PS) -26951 + (NN) -17350 + (LL) 3676
1D Compatibility (HY) -20400 + (ID) 5500
Total energy: -158380.0 ( -79.31 by residue)
QMean score : 0.460
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