Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKLTVVGLGYIGLPTSIMFAKHG--VDVLGVDINQQTIDKLQSGQISIEEPGLQEVYEEVLSSGKLKVST----TPEASDVFIIAVPTPNNDD---QYRSCDISLVMRALDSILPFLEKGNTIIVESTIAPKTMDDFVKPVIENLGFTIGEDICLVHCPERVLPGKILEELVHNNRIIGGVTKA-----CIEAGKYVYRTFVQG-EMI-ETDARTAEMSKLMENTYRDVNIALANELTKICNNLNINVLDVIEMANKHPRV--NIHQPGPGVGGHCLAVDPYFIIAKDPE---N--AKLIQTGREINNSMPAYVVDTTKQIIKAL-SGNKVTVFGLTYKGDVDDIRESPAFDIYELLNQEPDIEVCAYDPHVELD-F--V------------EHDMSHAVKDASLVLILSDHSEFKNLSDSHFDK-MK-HKVIFDTKNVVKSS-----FEDVSYYNYGNIFNFIDK |
2Q3E Chain:A ((6-466)) | KKICCIGAGYVGGPTCSVIAHMCPEIRVTVVDVNESRINAWNSPTLPIYEPGLKEVVESCR-GKNLFFSTNIDDAIKEADLVFISVNTPTKTYGMGKGRAADLKYIEACARRIVQNSNGYKIVTEKSTVPVRAAESIRR-IFDANTKPN-LNLQVLSNPEFLAEGTAIKDLKNPDRVLIGGDETPEGQRAVQALCAVYEHWV-PREKILTTNTWSSELSKLAANAFLAQRISSINSISALCEATGADVEEVATAIGMDQRIGNKFLKASVGFGGSCFQKDVLNLVYLCEALNLPEVARYWQQVIDMNDYQRRRFASRIIDSLFNTVTDKKIAILGFAFKKDTGDTRESSSIYISKYLMDE-GAHLHIYDPKVPREQIVVDLSHDQVSRLVTISKDPYEACDGAHAVVICTEWDMFKELDYERIHKKMLKPAFIFDGRRVLDGLHNELQTIGFQIETIGKK------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 2Q3E.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -222228 for 3445 contacts (-64.5/contact) +
2D Compatibility (PS) -43287 + (NN) -3504 + (LL) 16
1D Compatibility (HY) -18800 + (ID) 4850
Total energy: -292653.0 ( -84.95 by residue)
QMean score : 0.530
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