Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSTLPTQIAPNSSTSMAPTFLLVGMPGLSGAPSWWTLPLIAVYLLSALGNGTILWIIALQPALHRPMHFFLFLLSVSDIGLVTALMPTLLGIALAGAHTVPASACLLQMVFIHVFSVMESSVLLAMSIDRALAICRPLHYPALLTN----GVISKISLAISFRCLGLHLPLPFLLAYMPYCLPQVLTHSY--------CLHPDVARLACPEAWGAAYSLFVVLSAMGLDPLLIFFS-----YGLIGKVLQGVESR---EDRWKA---GQTCAAHLSAVL--LFYIPMILLALINHPEL--PITQHTHTLLSYVHFLLP---PLINPILYSVKMKE--------IRKRILNRLQPRKVGGAQ |
3PWH Chain:A ((14-305)) | ---------------------------------------LAIAVLAILGNVLVCWAVWLNSNLQNVTNYFVVSLAAADILVGVLAIP--FAITISTGFCAACHGCLFIACFVLVLAQSSIFSLLAIAIDRYIAIAIPLRYNGLVTGTRAAGIIA-ICWVLSFA-IGLTPMLGWNNCGQP-----------GCGEGQVACLFEDVV----PMNYMVYFNFF----ACVLVPLLLMLGVYLRIFAAARRQLKQMESQPLPGERARSTLQKEVHAAKSAAIIAGLFALCWLPLHIINCFTFFCPDCSHAPLWLMYLAIVLAHTNSVVNPFIYAYRIREFRQTFRKIIRS--------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3PWH.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -217286 for 1775 contacts (-122.4/contact) +
2D Compatibility (PS) -24924 + (NN) -9290 + (LL) 4848
1D Compatibility (HY) -26400 + (ID) 3700
Total energy: -276752.0 ( -155.92 by residue)
QMean score : 0.282
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