Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRVHITSIYGQSPRSIALISQKLVKDVGRQLGYDEMGIYFYNDHAETHGERSTRMDGIIAGLGRGDIVVFQVPTWNSTEFDELFLDKLQAY-GARIITFVHDIVPLMFESNFYLLDRVIDMYNRSDVVILPTKAMHDYLIEKGMTTSKVLYQEVW-DHPVNIDLP---------RPECQKVLSFAGDIQRF------PFVNDWK------ENIPLIYYGDGSRL---------NSEANVHAQGWKDDVELMLSLSKRGGFGLCWSEDREELVERRYSRMNASYKLSTFLAAGLPIIAN-HDISSRDFIKQHGLGFTVETLEEAVEKINNME--KETYDSYVENVEKIATLLRNGYITKKLLIDAVHMLYR |
3OT5 Chain:A ((112-393)) | -------------------------------------------------------------AENPDIVLVHGDTTTS--FAAGL---ATFYQQKMLGHVEAGLRTWNKYSPFPEEMNRQLTGVMADIHFSPTKQAKENLLAEGKDPATIFVTGNTAIDALKTTVQKDYHHPILENLGDNRLILMTAHRRENLGEPMQGMFEAVREIVESREDTELVYPMHLNPAVREKAMAILGGHERIHLIEPLDAIDFHNFLR-KSYLVFTD-----------S-----GGVQEEAPGMGVPVLVLRDTTERPEGIEAGTLKLIGTNKENLIKEALDLLDNKESHDKMAQAANPYG-----DGFAANRILAAIKSHFE |
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General information:
TITO was launched using:
| RESULT:
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Template: 3OT5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -141774 for 1898 contacts (-74.7/contact) +
2D Compatibility (PS) -26518 + (NN) -11804 + (LL) 5940
1D Compatibility (HY) 800 + (ID) 1500
Total energy: -174856.0 ( -92.13 by residue)
QMean score : 0.454
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