Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MAGSHPYFNQPDSTHPSPPSAPPSLRWYQRCQPSDATSGLLVALLGGGLPAGFVGPLSRMAYQASNLPSLELLIWRCLFHLPIALLLK-LRGDPLLGTPDIRSRAFFCALLNILSIGCAYSAVQVVPAGNAAT-VRKGSSTVCSAVLTLCLESQGLSGYDWCGLLGCILGLIIIVGPGLWTLQEGTTGVYTALGYVEAFLGGLALSLRLLVYRSLHFPPCLPTVAFLSGLVGLLGSVPGLFVLQAPVLPSDLLSWSCVGAVGILALVSFTCVGYAVTKAHPALVCAVLHSEVVVALILQYYMLHETVAPSDIVAAGVVLGSIAIITAQNLSCERTGRVEE |
| 2I68 Chain:A ((4-104)) | --------------------------------------------------------------------------YIYLGGAILAEVIGTTLM-------------VGTIICYCASFWLLAQTLA-----IAYAIWS-GVGIVLISLLSWGFFG------AIIGMMLICAGVLIINLL------------------------------------------------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2I68.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -46143 for 415 contacts (-111.2/contact) +
2D Compatibility (PS) -7872 + (NN) -4268 + (LL) 16188
1D Compatibility (HY) -7600 + (ID) 350
Total energy: -50045.0 ( -120.59 by residue)
QMean score : -0.232
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