Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MFANLKYVSLGILVFQTTSLVLTMRYSRTLKEEGPRYLSSTAVVVAELLKIMACILLVYKDSKCSLRALNRVLHDEILNKPMETLKLAIPSGIYTLQNNLLYVALSNLDAATYQVTYQLKILTTALFSVSMLSKKLGVYQWLSLVILMTGVAFVQWPSDSQLDSKELSAGSQFVGLMAVLTACFSSGFAGVYFEKILKETKQSVWIRNIQLGFFGSIFGLMGVYIYDGELVSKNGFFQGYNRLTWIVVVLQALGGLVIAAVIKYADNILKGF-ATSLSIILSTLISYFWLQDFVPTSVFFLGAILVITATFLYGYDPKPAGNPTKA |
2I68 Chain:A ((35-104)) | -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------GTIICYCASFWLLAQTLA-----IAYAIWSGVGIVLISLLSWGFF-G------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) -22017 for 237 contacts (-92.9/contact) +
2D Compatibility (PS) -5908 + (NN) -2401 + (LL) 21284
1D Compatibility (HY) -8000 + (ID) 250
Total energy: -17292.0 ( -72.96 by residue)
QMean score : -0.178
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