Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKKKSLLPLGLAIGLASLAASPLIQASTYTQTKYPIVLAHGMLGFDNILGV-DYWFGIPSALRRDGAQVYVTEVSQLDTSEV---RGEQLLQQVEEIVALSGQPKVNLIGHSHGGPTIRYVAAVRPDLIASATSVGAPHKGSDTADFLRQI---PPGSAGEAVLSGLVNSLGALISFLSSGSTGTQNSLGSLESLNSEGAARFNAKYPQ---GIPTSACGEGA--YKVNGVSY--YSWSGSS------------------PLTNFLDPSDAFLGASSLTFKNGTA--NDGLVGTCSSHLGMVIRDNYRMNHLDEVNQVFGLTSLFETSPVSVYRQHANRLKNASL |
2ES4 Chain:A ((1-315)) | -------------------------ADTYAATRYPVILVHGLAGTDKFANVVDYWYGIQSDLQSHGAKVYVANLSGFQSDDGPNGRGEQLLAYVKQVLAATGATKVNLIGHSQGGLTSRYVAAVAPQLVASVTTIGTPHRGSEFADFVQDVLKTDPTGLSSTVIAAFVNVFGTLV---SSSHNTDQDALAALRTLTTAQTATYNRNFPSAGLGAPGS-CQTGAATETVGGSQHLLYSWGGTAIQPTSTVTGATDTSTGTLDVANVTDPSTLALLATGAVMINRASGQNDGLVSRCSSLFGQVISTSYHWNHLDEINQLLGVRGANAEDPVAVIRTHVNRLK---- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2ES4.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -69278 for 2502 contacts (-27.7/contact) +
2D Compatibility (PS) -29690 + (NN) -6688 + (LL) 2664
1D Compatibility (HY) -22400 + (ID) 6350
Total energy: -131742.0 ( -52.65 by residue)
QMean score : 0.437
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