Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MIRAASDDPAGVDELVAAIAPGLAGLGL------PVINRREVVLVTGPWLAGVSGVRAALAERL-----------------PQRRFVETAELGPGD-------------APVAVVFVVSAATALTESDCVLLDTAAEHTDAVVAVVSKIDVHRGWRDVLTSNRDRLAARASRYARVPWVGAAAAPELGEPYLDDLVAAIQKQLADPAVARRNMLRAWESRLLMVARRFDGDAQSAGRRARVDALRQQRRTVLRQGRQSKSEHTIALRAQIQHARVKLSYFARNRCSLLRVELQEHVAGLSRKDIARFAAYTRGRVQEVVAEVGEGAVAHLADVAQLLGVPVQPPVLENLPAVLPTVVAPPLTSRRLEIRLTTLLGAGFGLGIALTLSRLVAGLTPGLAASGMVAGVAIGLAVTAWVVNARALLHDRVVVDRWTGEVTASLRSVVEQLVATRVVAVETLLSTAISERDDAENARVADQVSIIDGELREHAVAAARAAALRDREMPAVRAALEAVRAELGEPGAPTTGLF |
1MKY Chain:A ((147-354)) | -----AEHNINLDTMLETIIKKLEEKGLDLESKPEITDAIKV-AIVGRPNVGKSTLFNAILNKERALVSPIPVDDEVFIDGRKYVFVDTAGL----EKYSNYRVVDSIEKADVVVIVLDATQGITRQDQRMAGLMERRGRASVVVFNKWDLVVHREKRYDEFTKLFREKLYFIDYSPLIFTSADKG---WNIDRMIDAMNLAYA------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 1MKY.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -99727 for 1105 contacts (-90.3/contact) +
2D Compatibility (PS) -16708 + (NN) -3681 + (LL) 28780
1D Compatibility (HY) -8000 + (ID) 1550
Total energy: -100886.0 ( -91.30 by residue)
QMean score : 0.585
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