Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ----------------------------------------------------------------------------MDIKAEIQKLAKEIGISKIGFTTADNFDYLEKSLRASVEEGRNSGFEHKVIEDRIYPERLLESAKTIISIGVAYPHKLPQQPQKTSYKRGKITPNSWGLDYH----YVVGEKLDRLSKGIEELCRDFPLQQKAMVDTGALVDTAVAQRAGIGFIGKNGLVI--SKEYGSYMFLGELITNLEIEPDKPVDYDCGDCRRCLDACPTSCLIGDGSMNAKRCLSFQTQDKG-------MMDIEFRKKIKTVIYGCDICQICCPYNKGINNPLATEIDPELAQPELIPFLS--LSNGQF-----------------KEKFGMIAGSWRGKNILQRNAIIALANAHDKTAVVKLIE-----------------IIDKNNNPIHTATAI----WALGEIVKKPNDEILEFMSNLTLKDEDSRKELELIRHKWQF------------------ |
4Q0C Chain:A ((66-578)) | SQELTLVGKAAVPDVEVALDGDDWRWLARKRVLTLGVYAPDIPPFDVTYGERYEGLTADYMAIIAHNLGMQAKVLRYPTREQALSALESGQIDLIG--TVNGTDGRQQSLRLSVPYAADHPVIVMPIGARHVPASNLAGQRLAVDINYLPKETLARAYPQATLHYFPSSEQALAAVAYGQADVFIGDALTTSHLVSQSYFNDVRVVAPAHIATGGESFGVRADNTRLLRVVNAVLEAIPPSEHRSLIYRWGLGSSISLDFAHP-AYSAREQQWMADHPVVKVAVLNLFAP---FTLFRTDEQFGGISAAVLQLLQLRTGLDFEIIGVDTVEELIAKLRSGEADMAGALFVNSARESFLSFSRPYVRNGMVIVTRQDPDAPVDADHLDGRTVALVRNSAAIPLLQRRYPQAKVVTADNPSEAMLMVANGQADAVVQTQISASYYVNRYFAGKLRIASALDLPPAEIALATTRGQTELMSILNKALYSI--SNDELASIISRWRGSDGDPRTWYAYRNEIYLE |
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General information:
TITO was launched using:
| RESULT:
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Template: 4Q0C.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -5418 for 2692 contacts (-2.0/contact) +
2D Compatibility (PS) -37493 + (NN) -3022 + (LL) 712
1D Compatibility (HY) -8800 + (ID) 2600
Total energy: -56621.0 ( -21.03 by residue)
QMean score : 0.115
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