Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKQTLKLMFSFLLMLGTMFGISQTVLAQETHQLTIVHLEARDIDRPNPQLEIAPKEGTPIEGVLYQLYQLKSTEDGDLLAHWNSLTITELKKQAQQVFEATTNQQGKATFNQLPDGIYYGLAVKAGEKNRNVSAFLVDLSEDKVIYPKIIWSTGELDLLKVGVDGDTKKPLAGVVFELYEKNGRTPIRVKNGVHSQDIDAAKHLETDSSGHIRISGLIHGDYVLKEIETQS---------GYQIGQAETAVTIEKSK-TVTVTIENKKVPTPKVPSRGGLIPKTGEQQAMALVIIGGILIALALRLLSKHRKHQNKD |
3KPT Chain:A ((252-353)) | ----------------------------------------------------------------------------------------------------------------------------------------------------------IIELTKIDSAN--KNKMKGAEFVLKDNNGKIVVV---------AGKEVTGVSDENGVIKWSNIPYGDYQIFETKAPTYTKEDGTKTSYQLLKDPIDVKISENNQTVKLTIENNKS------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3KPT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -19590 for 610 contacts (-32.1/contact) +
2D Compatibility (PS) -10069 + (NN) -356 + (LL) 15140
1D Compatibility (HY) -3600 + (ID) 1300
Total energy: -19775.0 ( -32.42 by residue)
QMean score : 0.529
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