Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTRPQAAAEDARNAMVAGLLASGISVNGLQPSHNPQVAAQMFTTATRLDPKMCDAWLARLLAGDQSIEVLAGAWAAVRTFGWETRRLGVTDLQFRPEVSDGLFLRLAITSVDSLACAYAAVLAEAKRYQEAAELLDATDPRHPFDAELVSYVRGVLYFRTKRWPDVLAQFPEATQWRHPELKAAGAAMATTALASLGVFEEAFRRAQEAIEGDRVPGAANIALYTQGMCLRHVGREEEAVELLRRVYSRDAKFTPAREALDNPNFRLILTDPETIEARTDPWDPDSAPTRAQTEAARHAEMAAKYLAEGDAELNAMLGMEQAKKEIKLIKSTTKVNLARAKMGLPVPVTSRHTLLLGPPGTGKTSVARAFTKQLCGLTVLRKPLVVETSRTKLLGRYMADAEKNTEEMLEGA---LGGAVFFDEMHTLHEKGYSQGDPYGNAIINTLLLYMENH---RDELVVFGAGYAKAMEKMLEVNQGLRRRFSTVIEFFSYTPQELIALTQLMGRENEDVITEEESQVLLPSYTKFYMEQSYSEDGDLIRGIDLLGNAGFVRNVVEKARDHRSFRLDDEDLDAV--LASD------L----------TEFSED--QLRRFKELTREDLAEGLRAAVAEKKTK |
3EIE Chain:A ((13-304)) | --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------PNVKWEDVAGLEGAKEALKEAVILPV---KFPHLFKGNRKPTSGILLYGPPGTGKSYLAKAVATEA-------NSTFFSVSSSDLVSKWMGESEKLVKQLFAMARENKPSIIFIDQVDALTGT------EASRRIKTELLVQMNGVGNDSQGVLVLGATNIPWQ-----LDSAIRRRFERRIYIPLPDLAARTTMFEINVGDTPCVLTKEDYRTLGAMTEGYS--------------------GSDIAVVVKDALMQPIRKIQSATHFKDVS----ETRKLTPCSPGDDGAIEMSWTDIEADELKEPDLTIKDFLKAIKSTRPTVNE- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3EIE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -82780 for 1993 contacts (-41.5/contact) +
2D Compatibility (PS) -27608 + (NN) -6353 + (LL) 26676
1D Compatibility (HY) -7600 + (ID) 2350
Total energy: -100015.0 ( -50.18 by residue)
QMean score : 0.452
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