Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MEKSSIYGLTWTNLTEWLEAHGQKKFRATQVWDWLY--RKRVKTFE---EMSNVPKETIELLTANFVMNTLEEQVVQ-------ESTDGTTKYLFKLSDGNL----------IETVMMKQ-----EYGLSVCVTTQVGCNIGCTFCASGLLK--KSRDLTAGEIVEQIMNVQHYLDGRNLEERVSHVVVMGIGEPFDNY-DNVMDFLRVINHDKGLAIGARHITVSTSGL-----AP-RIIDFANEDFQVNLAISLHAPNNELRTSIMRINKTYSIEKLMEAIHYYVNKTNRRITFEYIMLKGVNDHKKEALELAALLGEHRHLAYVNLIPYNPVDEHIDYERSTKEDVLAFYDTLKKNGINCVIRREHGTDIDAACGQLRSKQIKRVGVRERMKQKQAAAEE |
| 2A5H Chain:A ((10-317)) | -----------------------KDVSDADWNDWRWQVRNRIETVEELKKYIPLTKEEEEGVAQCVKSLRMAITPYYLSLIDPNDPNDPVRKQAIPTALELNKAAADLEDPLHEDTDSPVPGLTHRYPDRVLLLITDMCSMYCRHCTRRRFAGQSDDSMPMERIDKAIDYIRNT-------PQVRDVLLSG-GDALLVSDETLEYIIAKL-REIP-HVEIVRIGSRTPVVLPQRITPELVNMLKKYH-PVWLNTHFNHPNEI-------------TEESTRACQLLAD-AGVPLGNQSVLLRGVNDCVHVMKELVNKLVKIR-VRPYYIYQCDLSLG-LEHFRTPVSKGIEIIEGLRG--------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2A5H.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -80318 for 2089 contacts (-38.4/contact) +
2D Compatibility (PS) -28933 + (NN) -11015 + (LL) 7060
1D Compatibility (HY) -8800 + (ID) 2200
Total energy: -124206.0 ( -59.46 by residue)
QMean score : 0.313
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