Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSNEDMEQDNTTLLTEFVLTGLTYQPE------WKMPLFLVFLVIYLITIVWNLGLIALIWNDPQLHI-----PMYFFLGSLAFVDAWISSTVTPKMLVN----------FLAKNRMISLSECMIQFFSFAFGGTTECFLLATMAYDRYVAICKPLLYPVIMNNSLCIRLLAFS------FLGGFLHALI------------HEVLIFRLTFCNS----------------NIIHHFYCDIIPLFMISCTDPSINF-----------------------------------LMVFILSGSIQVFTIVTVLNSYTFALFTILKKKSVRG------VRKAFSTCGAHLLSVSLYYGP---------------LIFMYLRPASPQADDQDMIDS----------VFYTIIIPL-LNPIIYSLRNKQVIDSFTKMVKRNV-------------- |
2W45 Chain:A ((7-466)) | -LEDPMEEMTSYTFARFLRSPETEAFVRNLDRPPQMPAMRFVYLYCLCKQIQEFSGETGFCDFVSSLVQEDGPSLKSIYWGLQEATDEQRTVLCSYVESMTRGQSENLMWDILRNGIISSSKLLSTIKNGPTKVFEPAFGGPVAFGLRCEDTVKDIVCKLICGDASANRQFGFMISPTDGIFGVSLDLCVNVESQGDFILFTDRSCIYEIKCRFKYLFSKSEFDPIYPSYTALYKRPCKRSFIRFINSIARPTVEYVPDGRLPSEGDYLLTQDEAWNLKDVRKRKLGPGHDLVADSLAANRGVESMLYVMTDPSENAGRIGIKDRVPVNIFINPRHNYFYQVLLQYKIVGDYVRHSGGGKPGRDCSPRVNIVTAFFRKRSPLDPATCTLGSDLLLDASVEIPVAVLVTPVVLPDSVIRKTLSTAAGSWKAYADNTFDTAPWVPSGLFADD |
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General information:
TITO was launched using:
| RESULT:
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Template: 2W45.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -291269 for 2181 contacts (-133.5/contact) +
2D Compatibility (PS) -31930 + (NN) 569 + (LL) 208
1D Compatibility (HY) -8800 + (ID) 2050
Total energy: -333272.0 ( -152.81 by residue)
QMean score : 0.153
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