Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLQNIGQTGIQATRIALGCMRMSD--LEGKQAEEVVGTALDLGINFFDHADIYGG--GLSELRFRDAIKHL-NVNRDKMIIQSKCGIREG----YFDFSKEYILSSVDGILERLGTEYLDFLILHRPDVLVEPEEVAEAFTKLRAEGKVKHFGVSNQNRFQMELLQSYL---DEPLAVNQLQLSPAHTPMFDAGLNVNMLNKASIEHDDGIVDYCRLKRVTIQAWSPFQIDLSRGLFVNHPD-----YKELNETIAKLAKNYNVSSEAIVIAWILRHPAQIQAIVGSMNPSRLKAIDKAND-IALTREEWYDIYRSAGNILP |
3ERP Chain:A ((35-350)) | EYRRCGRSGVKLPAISLGLWHNFGDTTRVENSRALLQRAFDLGITHFDLANNYGPPPGSAECNFGRILQEDFLPWRDELIISTKAGYTMWDGPYGDWGSRKYLIASLDQSLKRMGLEYVDIFYHHRPDPETPLKETMKALDHLVRHGKALYVGISNYPADLARQAIDILEDLGTPCLIHQPKYSLFERWVE-----------------DGLLALLQEKGVGSIAFSP----LAGGQLTDRYLNITADKLEKVRRLNELAARRGQKLSQMALAWVLRNDNVTSVLIGASKPSQIEDAVGMLANRRFSAAECAEIDAILEGRF- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3ERP.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -152380 for 2387 contacts (-63.8/contact) +
2D Compatibility (PS) -29989 + (NN) -14433 + (LL) 1164
1D Compatibility (HY) -9200 + (ID) 3550
Total energy: -208388.0 ( -87.30 by residue)
QMean score : 0.544
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