Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequence-----------------------------------------MTIQWFPGHMAKAR-REVTEK-LKLVDVIFELVDARIPLSSSNPMLEEIIHQ--KRRVIILNKADTADEKTTKEWIDYFAEKGLPAVAVNAQEGKGLFK-IEQAAEKLMAEKFDRLRSKGMKPRAIRAMILGIPNVGKSTLINRLAKKNIARTGNKPGVTKAQQWIKVGKTLELLDTPGILWPKFEDQEIGYKLA---------LTGAIKDDLL-QME-EIAGYGLRFLEN---HYPDRLQTWLKVETVSEDPIETLAFIAEK-----------------RGLLDRYNDPDYSRAAETVVREIRQQKLGRMSFDFPNWEDEVE-----------------------------------------------
1MKY Chain:A ((2-439))ATVLIVGRPNVGKSTLFNKLVKDPVQDTVEWYGKTFKLVDTCGVFDNPQDIISQKMKEVTLNMIREADLVLFVVDGKRGITKEDESLADFLRKSTVDTILVANKAENLREFEREVKPELYSLGFGEPIPVSAEHNINLDTMLETIIKKLEEKG-LDLESKPEITDAIKVAIVGRPNVGKSTLFNAILNKERALVSPIPVDDEVFID---GRKYVFVDTAGLEKYSNYRVVDSIEKADVVVIVLDATQGITRQDQRMAGLMERRGRASVVVFNKWDLVVHREKRYDEFTKLFREKLYFIDYSPLIFTSADKGWNIDRMIDAMNLAYASYTTKVPSSAINSALQKVLAFTNLPRGLKIFFGVQVDIKPPTFLFFVNSIEKVKNPQKIFLRKLIRDYVFPFEGSPIFLKFKRSR


General information:
TITO was launched using:
RESULT:

Template: 1MKY.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -2099 for 1748 contacts (-1.2/contact) +
2D Compatibility (PS) -29919 + (NN) -5484 + (LL) 592
1D Compatibility (HY) -4400 + (ID) 2550
Total energy: -43860.0 ( -25.09 by residue)
QMean score : 0.273

(partial model without unconserved sides chains):
PDB file : Tito_1MKY.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-1MKY-query.scw
PDB file : Tito_Scwrl_1MKY.pdb: