Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MFKSLHQYAHVFSRLSLFGLAFAAAAQAQSQSLTVISFGGATKAAQEQAYFKPFERSGGGQVVAGEYNGEMAKVKAMVDVGKVSWDVVEVESPELLRGCDEGLFERLD----PARFGDPAQFVPGTFSECGVATYVWSMVMAYDSTKLARAPQSWADFWNVREFPGKRGLRKGAKYTLEVALLADGVKAEDLYKVLATPEG-----VSRAFAKLDQLKPNI-QWWEAGAQPPQWLAAGDVVMSAAYNGRIAAAQKEGVKLAIVW----PGSLYDPEYWAVVKGTPNKALAEKFIAFASQPQTQKVFSEQIPYGPVHKGTLALLPKTVQEALPTAPANLEGARAVDAEFWVDHGEELEQRFNAWAAR |
3PU5 Chain:A ((8-282)) | --------------------------------IYVTSSGGSFLENVRKHMAEPFEKQSGVKVTLVPGTNPAHALKILSSRGTPPYDVAAFGGNDMYRLIRAKKLAQVDEKSVPSLADVPEKF-KADWEGCGSLYDYSSVGIAYRPDKIQGGVKSWKEFVE-RTVAGEFGKQ------VFFNNLSSNVRGAEVLSMFGKIYGSGYGDIEASIATLERMKPHIFKFFTAFNDPVVLLTSGEGAIGPGWDGRTFIAE-DSTKGMVKWVDPTEGAVSSGPVMAVVKGG-KEDLAKAFMNYALGEEAQKAFCEAMYYGAVNRKVQYSEKLKHRLPSIDSVQLVDTALLIKNMSALLDLWNKRIA------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3PU5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -75630 for 2138 contacts (-35.4/contact) +
2D Compatibility (PS) -28603 + (NN) -13115 + (LL) 4116
1D Compatibility (HY) -14000 + (ID) 3200
Total energy: -130432.0 ( -61.01 by residue)
QMean score : 0.411
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