Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSVLNIEGAKLSYQKVGQGP-ILIFIPGANGTGDI-FLPLAEQL-KTSFSVVMVDRRGYGDSELTAAIPERASHAYDDYRVTRDAADIAALAKALSDVPVYILGSSSGSIVAMHVLKNHPEVVKKIAFHEPPINTFLPDSEMWQEANEKIVQTALTKNMAEAMQLFGETLHIAPIDAESMSKPAVTIDEVTKDSTTQQMKYWFTYEIRQYTSSNISLDDFKPYVHQITLLNGTDSKGSFPQDVNAFIAKQLGLTIVDIPGGHLGYIQKPAGFAKVLLSIWG |
2OCL Chain:A ((9-122)) | -----VNGVQLHYQQTGEGDHAVLLLPGMLGSGETDFGPQLKNLNKKLFTVVAWDPRGYGHSR----PPDRDFPA--DF-FERDAKDAVDLMKALKFKKVSLLGWADGGITALIAAAKYPSYIHKM----------------------------------------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2OCL.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -79910 for 876 contacts (-91.2/contact) +
2D Compatibility (PS) -12047 + (NN) -8654 + (LL) 11436
1D Compatibility (HY) -5200 + (ID) 2150
Total energy: -96525.0 ( -110.19 by residue)
QMean score : 0.533
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