Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSGTSSMGL-----PPGPRLSGSVQAVLMLRHGL-RFLTACQRRYGSVFTLHVAGFGHMVYLSDPAAIKTVFAGNP-SVFHAGEANSMLAGLLG--DSSLLLIDDDVHRDRRRLMSPPFHRDAVARQAGPIAEIAAANIAGW----PMAKAFAVAPKMSEITLEVILRTVIGAS--------DPV-----RLAALRKVMPRLLNVGPWA----TLALANPSLLNNRLWSRLRRRIEEADALLYAEIADRRADPDLAARTDTLAMLVRAAD-EDGRTMTERELRDQLITLLVAGHDTTATGLSWALERLTRHPVTLAKAVQAADASAAGD--PAGD-----EYLDAVAKETLRIRPVVYDVGRVLTEAVEVAGYRLPAGVMV-VPAIGLVHASAQLYPDPERFDPDRMVGA---TLSPTTWLPFGGGNRRCLGATFAMVEMRVVLREILRRVELSTTTTSGERPKLKHVIMVPHRGARIRVRATRDVSATSQATAQGAGCPAARGGGPSRAVGSQ |
5A1P Chain:A ((6-446)) | --GTHSHGLFKKLGIPGPTPLPFLGNILSYHKGFCMFDMECHKKYGKVWGFY-DGQQPVLAITDPDMIKTVLVKECYSVF----TNRRPFGPVGFMKSAISIAEDEEWKRLRSLLSPTFTSGKLKEMVPIIAQYGDVLVRNLRREAETGKPVTLKDVFGAYSMDVITSTSFGVNIDSLNNPQDPFVENTKKLLRFDFLDPFFLSITVFPFLIPILEVLNICVFPREVTNFLRKSVKR--------MKESRLEDT---RVDFLQLMIDSQNS-SHKALSDLELVAQSIIFIFAGYETTSSVLSFIMYELATHPDVQQKLQEEIDAVLPNKAPPTYDTVLQMEYLDMVVNETLRLFPIAMRLERVCKKDVEINGMFIPKGVVVMIPSYAL-HRDPKYWTEPEKFLPERFSKKNKDNIDPYIYTPFGSGPRNCIGMRFALMNMKLALIRVLQNFSFK------------------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 5A1P.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -237853 for 3046 contacts (-78.1/contact) +
2D Compatibility (PS) -42681 + (NN) -24538 + (LL) 4952
1D Compatibility (HY) -33200 + (ID) 5650
Total energy: -338970.0 ( -111.28 by residue)
QMean score : 0.485
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