Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRARRLVMLRHGQTDYNVGSRMQGQLDTELSELGRTQAVAAAEVLGK--RQPLLIVSSDLRRAYDTAVKLGERT---GLVVRVDTRLRETHLGDWQGLTHAQIDADAPGA-RLAWRED-------------------------ATWAPHGGESRVDVAARSRPLVAELVASEPEWGGADEPDRPVVLVAHGGLIAALSAALLKLPVANWPALGGMGNASWTQLSGHWAPGSDFESIRWRLDVWNASAQVSSDVL |
3KKK Chain:A ((2-231)) | -TTYTLVLLRHGESTWNKENKFTGWTDVPLSEKGEEEAIAAGKYLKEKNFKFDVVYTSVLKRAICTAWNVLKTADLLHVPVVKTWRLNERHCGSLQGLNKSETAKKYGEEQVKIWRRSYDIPPPKLDKEDNRWPGHNVVYKNVPKDALPFTECLKDTVERVLPFWFDHIAPDI------LANKKVMVAAHGNSLRGLVKHLDNLSEADVLE-LNIPTGVPLVYELDEN-------LKPIKHYYLL--------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3KKK.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -51083 for 1587 contacts (-32.2/contact) +
2D Compatibility (PS) -21349 + (NN) -7080 + (LL) 824
1D Compatibility (HY) -8000 + (ID) 2400
Total energy: -89088.0 ( -56.14 by residue)
QMean score : 0.297
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