Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MPKPKKNTLPCSLSVKMSYFMRLLIKWRTRSLSHKMMTLVQILSILALASKASEDLEEQLKKIKDYIYKTLNAKIASDVYDRVLILVNEYCANEELFDKESVKISDLLI--------------------QDIQLYALVDEMLKEDKYQVQHTILKGIIKRKYDEAYSLNSEDRILLEYQERLLEPSYASFSNKKFK |
3BAB Chain:A ((6-111)) | ------------------------------------------LTLTAATTRAQE-LRKQLNQYSHEYYVKDQPSVEDYVYDRLY---------KELVDIET-EFPDLITPDSPTQRVGGKVLSGFEKAPHDIPMYSLNDGFSKEDIFAFDERVRKAIGKPVAYCCELKIDGLAISLRYENGVFVRGATRGDGTVGE |
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General information:
TITO was launched using:
| RESULT:
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Template: 3BAB.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -3997 for 427 contacts (-9.4/contact) +
2D Compatibility (PS) -8855 + (NN) -673 + (LL) 4612
1D Compatibility (HY) -6800 + (ID) 1450
Total energy: -17163.0 ( -40.19 by residue)
QMean score : 0.215
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