Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLFDTHAHLNAEQY----------DTDLEEVIERAKAEKVERIVVVGFDRPTITRAMEMIEEYD-F----IYAAIGWHPVDAIDMT-EEDLAWIKELSA--HEKVVAIGEMGLDYHWDK-SPKDIQKEVFRNQIALAKEV-NLPIIIHNRDATEDVVTILKEEGAEAVG-GIMHCFTGSAEVARECMKMNFYLSFGGPVTFKNAKKPKEVVKEIPNDRLLIETDCPFLTPHPF-R-----------------------GKRNEPSYVKYVAEQIAELKEMTFEEIASITTENAKRLFRIN |
3IPW Chain:A ((27-323)) | QFIDIGANLTDDNYFGNYHGKHYHEEDIDVVLQRAERNGLSHIIITSGCLNDFKKAIEIINKYQNLTNIKLVTTIGVHPTRTNELKQEGYLDELLLLCEKNIDKVVAIGEIGLDYERLQFSDKETQLSGYRTLSILHQKYPYLPFFFHCRKSWSDLCQLNKELGY-NGCKGVVHCFDGTEEEMNQILNEGWDIGVTGNSLQS--IELLNVMKQIPIERLHIETDCPYCGIKKTSAGFKYLKEKDFGVKVEKYQRNKYVQRRNEPSNIIDIAIIMSSIKHISLFEFVNKVYSNSMNMYFPT |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IPW.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -132771 for 2161 contacts (-61.4/contact) +
2D Compatibility (PS) -26871 + (NN) -8192 + (LL) 168
1D Compatibility (HY) -17600 + (ID) 3600
Total energy: -188866.0 ( -87.40 by residue)
QMean score : 0.601
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