Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTYQEALEWIHSKLAFGIKPGLERMRWMLEQLGNPQNNLSAIHVVGTNGKGSTTSYLQHIFTNSGYQVGTFTSPYIVDFRERISIDGQMIPESDFIKLVETVRPVVERLHLETNLEPATEFEVITVLMFYYFGNSCPVDIVIIEAGMGGYYDSTNMFKALAVTCPSIGLDHQEVLGRTYVDIAEQKVGVLKKGVPFVYANDR-QDVEEVFQIKAKETHSQT------YRLHNDFYIKEEENYFNYIGPQANIDHIQLQMPGHHQVSNASIAITTSLL--LRDKYPKLTLQTIKDGLE-MTKWVGRTELIF--PNVMIDGAHNNESVDALVQVIKK-YQQKNVHILFAAINTKPIESMLESLSSIA-PVSVTSFDYPKSINLDKYPK-A--YTRVSDWKKWLH-DINLTSDKDFYVITGSLYFISQVRQELLLIKTTTT |
3NRS Chain:A ((14-436)) | SPLAAWLCYLEHL-------GLERVKQVAERLDLLKPAPKIFTVAGTNGKGTTCCTLEAILLAAGLRVGVYSSPHLLRYTERVRIQGQELSEAEHSHSFAQIEAG-------RGDISLTYFEFGTLSALQLFKQA-KLDVVILEVGLGGRLDATNIVDSDVAAITSIALDHTDWLGYDRESIGREKAGVFRGGKPAVVGEPDMPQ---SIADVAAELGAQLYRRDVAWKFSQ-------NGWH-WQC--GERQLTGLPVP-NVPLANAATALAVLHYSEL-----PLSDEAIRQGLQAA-SLPGRFQVVSEQPLLILDVAHNPHAARYLVNRLAQVI--GKVRAVVGMLSDKDIAGTLACLSERVDEWYCAPLEGPRGASAGQLAEHLVSARQFSDVETAWRQAMQDADTQDVVIVCGSFHTVAHVMAALHL------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3NRS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -232082 for 3330 contacts (-69.7/contact) +
2D Compatibility (PS) -40872 + (NN) -13916 + (LL) 3044
1D Compatibility (HY) -18000 + (ID) 4650
Total energy: -306476.0 ( -92.03 by residue)
QMean score : 0.539
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