Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MADKVQTTLLFLAVGEFSVGILGNAFIGLVNCMDWVKKRKIASIDLILTSLAISRICLLCVILLDCFILVLYPDVYATGKEMRIIDFFWTLTNHLSIWFATCLSIYYFFKIGNFFHPLFLWMKWRIDRVISWILLGCVVLSVFISLPATENLNADFRFCVKAKRKTNLTWSC------RVNKTQHASTKLFLNLATLLPFCVCLMSFFLLILSLRRHIRRMQLSAT-----------------------------------------------------------------------------------------------------------------------------------------------------GCRDPSTEAHVRALKAVISFLLLFIAYYLSFLIATSSYF-MP----ETELAVIFGESIALIYPSSHSFILILGNNKLRHASLKVIWKVMSILKGRKFQQHKQI |
3EML Chain:A ((22-472)) | ------SVYITVELAIAVLAILGNVLVCWAVWLNSN---LQNVTNYFVVSLAAADIAVGVLAIPFAITIS--TGFCAACHGCLFIACFVLVLTQSSIFSLLAIAIDRYIAIR---IPLR-YNGLVTGTRAKGIIAICWVLSFAIGLTPMLGWN--N--CGQ----SQGCGEGQVACLFEDVVPMNYMVYFNFFACVLVPLLLMLGVYLRIFLAARRQLNIFEMLRIDEGLRLKIYKDTEGYYTIGIGHLLTKSPSLNAAKSELDKAIGRNTNGVITKDEAEKLFNQDVDAAVRGILRNAKLKPVYDSLDAVRRAALINMVFQMGETGVAGFTNSLRMLQQKRWDEAAVNLAKSRWYNQTPNRAKRVITTFRTGTWDAYRSTLQKEVHAAKSLAIIVGLFALCWLPLHIINCFTFFCPDCSHAPLWLMYLAIVLSHTNSVVNPFIYAYRIREFRQTFRKIIRSHVLRQ----------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3EML.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -233948 for 2110 contacts (-110.9/contact) +
2D Compatibility (PS) -29102 + (NN) -8009 + (LL) 3040
1D Compatibility (HY) -16400 + (ID) 2300
Total energy: -286719.0 ( -135.89 by residue)
QMean score : 0.155
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