Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MIELGITTFGETTILEETNQSYSHPERIRQLVAEIELADQVGLDVYGIGEHHRED----------------FAVSAPEIVLAAGAVRTNNIRLSSAVTILSSNDPIRVYQQFSTIDALSNGRAEIMAGRGSFIESFPLFGYD----LADYDDLFNEKMDMLLAINSAT----------------------NLDWKGH-LTQTVNERPIYPRALQRQLPIWVATGGNVDSTIRIAEQGLPIVYATIGGNPKAFRQLVHIYKEVGSRNGHKPEQLKVAAHSWGWIEEDNQTAIDRYFFPTKQTVDN-----IAK----GRPHWS------EMTKEQYLRS----VGPEGAIFVGSPEVVAHKIIGLVEALELDRFMLHLPVGSMPHKDVLNAIKLYGKEVAPIVRKYFEKN |
3B9O Chain:A ((34-402)) | -------------------------TDLNYWTELAQLLEKGKFDALFLADVVGIYDVYRQSRDTAVREAVQIPVNDPLMLISAMAYVTKHLAFAVTF-STTYEHPYGHARRMSTLDHLTKGRIAWNVVTSHLPSADKNFGIKKILEHDERYDLADEYLEVCYKLWEGSWEDNAVIRDIENNIYTDPSKVHEINHSGKYFEV--PGPHLCEPSPQRTPVIYQAGM-SERGREFAAKHAECVFLGGK--DVETLKFFVDDIRKRAKKYGRNPDHIKMFAGICVIVGKTHDEAMEKLNSFQKYWSLEGHLAHYGGGTGYDLSKYSSNDYIGSISVGEIINNMSKLDGKWFKLSVGTPKKVADEMQYLVEEAGIDGFNLVQYV-------SPGTFVDFIELVVPELQKRGLYR |
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General information:
TITO was launched using:
| RESULT:
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Template: 3B9O.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -122923 for 2340 contacts (-52.5/contact) +
2D Compatibility (PS) -32611 + (NN) -10937 + (LL) 1296
1D Compatibility (HY) -10400 + (ID) 2450
Total energy: -178025.0 ( -76.08 by residue)
QMean score : 0.482
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