Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNKKIAGIGLASIAVLSLAACGHRGASKSGGKSDS----LKVAMV------TDTGGVDDKSF-NQSGWEGMQAWGKK----NGLKKGAGFDYFQSASESDYATNLDTAVSSGYKLIFGIGFSLHDAIDKAADNN--KDVNYVIVDDVIKGK---------------------DNVASVVFADNESAYLAGIAAAKTTKTKTVGFV-GGMESEVITRFEKGFEAGVKSVDKSIKIKVDYAGSFGDAAKGKTIAAAQYASGADIVYQVAGGTGAGVFSEAKSRNESLKEADKVWVLGV--------DRDQAAEGKYTSKDGKASNF---VLASSIKEVGKSVELIATKTSKGKFPGGNVTTYGLKDGGV---DIATTNL-SDDAVKAIKEAKAKIISGDIKVPSK------------------------- |
3WRY Chain:A ((8-431)) | -SPRVFCIGTADTKFDELRFLSEHVRSSLNSFSNKSSFKVGVTVVDVSTSWKETNSCADFDFVPSKDVLSCHTLGEETMGTFADTRGLAIAIMSKALETFLSIANDEQNLAG---VIGLGGSGGTSLLSSAFRSLPIGIPKVIISTVASGQTESYIGTSDLVLFPSVVDICGINNVSKVVLSNAGAAFAGMVIGRLESKFTVGVTMFGVTTPCVNAVKERLVKE-GYETLVFHATGVGGRAMEDLVRGGFIQGVLDITTTEVADYVVGG----VMACDSSRFDAILEKKIPLVLSVGALDMVNFGPKTTIPPEFQQRKIHEHNEQVSLMRTTVGENKKFAAFIAEKLNKASSS----VCVCLPEKGVSALDAPGKDFYDPEATSCLTRELQMLLENNERCQVKVLPYHINDAEFANALVDSFLEISPK |
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General information:
TITO was launched using:
| RESULT:
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Template: 3WRY.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -16710 for 2564 contacts (-6.5/contact) +
2D Compatibility (PS) -35911 + (NN) -5268 + (LL) 352
1D Compatibility (HY) -14000 + (ID) 3100
Total energy: -74637.0 ( -29.11 by residue)
QMean score : 0.338
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