Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLRSKFDEELDKLHNQFYAMGIEAIGQIKKTVRAFVSHDRELAKEVIEDDVTLNNFETKLEKKSLEIIALQQPVSQDLRTVITVLKATSDVERMGDHAAAVAKATIRMKGEERIPAVELEINNMGKAVKNMLEEALTAYINGDDEKAYEVAAMDEIVDDYFRDIQKMVVETIQKHPDVAFAAKEYFQVLMHLERIGDYGKNICEWIVYLKTGKIIEL |
1VCT Chain:A ((15-110)) | ---------------------------------------------------------------------------------------------------------------------KEIFIEMKDTVELMVDLAYASLLFGDKEIAEEVLELEERIDLLNYQLMMHSVLAARN-VKEAEQVITILQIANAIEDISNAAGDLAKMVLEGVELHPVIK |
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General information:
TITO was launched using:
| RESULT:
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Template: 1VCT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -38426 for 644 contacts (-59.7/contact) +
2D Compatibility (PS) -10483 + (NN) -6052 + (LL) 10532
1D Compatibility (HY) -2800 + (ID) 850
Total energy: -48079.0 ( -74.66 by residue)
QMean score : 0.520
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