Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ------MVKLTTKIASLKLFASYAIATYILVMLTSALNLFKGYVADTFYIAETLLIILTIILIIILTTEQTWKHHDLWRRIVEVLLLLMALTGNVFTLLMFVSIRRYQRTSQIHSYNGWESFIRKTTRHRIAIIGLLILVYMLTLSIVSQFTFDTTLATKNQFNALLHGPSLAYPFGTDDFGRDLFTRVVVGTKLTFSISIISVVIAVIFGVLLGTIAGYFNHIDNLIMRILDVVFAIPSLLLAVAIIASFGASIPNLIIALSIGNIPSFARTMRASVLEIKRMEYVDAARITGENTWNIIWRYILPNAIAPMIVRFSLNIGVVVLTTSSLSFLGLGVAPDVAEWGNILRTGSNYLETHSNLAIVPGVCIMFVVLAFNFIGDAVRDALDPRIH |
3BXV Chain:A ((1-308)) | MPKPYIAINMADLKNEPKTFEMFSAVGPKVCMVTARHPGFVG--------------FQNHVQIGVLPFGERFGGAKMD----------MTKESSTVRVLQYTMWKDWKDHEEMHRQNWSYLFRLCYSCASQMVWGPWEPIYEIKYADMPINT-EMTDFTAVVGKKFAEGKPLEIPVISQPYGK----RVVAFGEHTV-------------------IPGKEEQFEDAIIKTLEMFKRAPGFL-GAMLLKEIGVS--------GIGS------------FQFGSKGFHQLLESPGSLEPD-------PNNVMYQAPEAKPT------PPQYIVHVEWANLDALQFGMGRVLLSPEYREVHDEALDTLIYGPYIRIINPVMEGTFWREYLNE--- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3BXV.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -266820 for 2400 contacts (-111.2/contact) +
2D Compatibility (PS) -31980 + (NN) -2594 + (LL) 10152
1D Compatibility (HY) -4000 + (ID) 2250
Total energy: -297492.0 ( -123.96 by residue)
QMean score : 0.181
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