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



Input alignment information:
Query sequence------MTKSEKIIELTNHYGAHNYLPLPIVISEAEGVWVKDPEGNKYMDMLSAYSAVNQGHRHPKIIQALKDQADKVTLVSRAFHSDNLGEWYEKIC-KLAGK---DKALPMNTGAEAVETALKAARRWAYDVKGIEPNKAEIIAFNGNFHGRTMAPVSLSSEAEYQR-GYGPLLDGFRKVDFGDVDALKAAINE-NTAAVLVEPIQGEAGINIPPEGYLKAIRELCDEHNVLFIADEIQAGLGRSGKLFATDWDNVK--PDVYILGKALGGGVFPISVVLADKEVLDVFTPGS--HGSTFGGNPLACAASIAALDVIVDEDLPGRSLELGDYFKEQLKQIDHPSIKEVRGRGLFIGVEL----NESARPYCEALKEEGLLCKET-HDTVIRFAPPLIITKEELDLALEKIRHVFQ--
2OAT Chain:A ((36-439))GPPTSDDIFEREYKYGAHNY-----HPLPVALERGKGIYLWDVEGRKYFDFLSSYSAVNQGHCHPKIVNALK-SQVDKL--TLTSRA-FYNNVLGEYEEYITKLFNYHKVLPMNTGVEAGETACKLARKWGYTVKGIQKYKAKIVFAAGNFWGRTLSAISSSTDPTS-YDGFGPFMPGFDIIPYNDLPALERALQDPNVAAFMVEPIQGEAGVVVPDPGYLMGVRELCTRHQVLFIADEIQTGLARTGRWLAVDYEN--VRPDIVLLGKALSGGLYPVSAVLCDDDIMLTIKP--GEHGSTYGGNPLGCRVAIAALEVLEEENLAENADKLGIILRNELMKLPSDVVTAVRGKGLLNAIVIKETKDWDAWKVCLRLRDNGLLAKPTH-GDIIRFAPPLVIKEDELRESIEIINKTILSF


General information:
TITO was launched using:
RESULT:

Template: 2OAT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -192248 for 3271 contacts (-58.8/contact) +
2D Compatibility (PS) -42023 + (NN) -22065 + (LL) 464
1D Compatibility (HY) -36000 + (ID) 8300
Total energy: -300172.0 ( -91.77 by residue)
QMean score : 0.573

(partial model without unconserved sides chains):
PDB file : Tito_2OAT.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2OAT-query.scw
PDB file : Tito_Scwrl_2OAT.pdb: