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



Input alignment information:
Query sequenceMNTHFPDAETVRTVLTLAVRAPSIHNTQPWRWRVCPTSLELFSRPDMQLRSTDPDGRELILSCGVALHHCVVALASLGWQAKVNRFPDPKDRCHLATIGVQPLVPDQADVALAAAIPRRRTDRRAYSCWPVPGGDIALMAARAAR-------GGVMLRQVSA---LDRMKAIVAQAVLDHVTDEEYLRELTIWSGRYGSVAGVPARNEPPSDPSAPIPGRLFAGPGLSQPSDVLPADDGAAILALGTETDDRLARLRAGEAASIVLLTATAMGLACCPITEPLEI--AKTRDAVRAEV-FGAGGYPQMLLRVGWAPINADPLPPTPRRELSQVVEWPEELLRQRC
3EK3 Chain:A ((4-188))------------------------------------------------------------------------------------------------------------TNEVLETIKARRSVR-AYDRKQIPADDLNAILEAGAYAPSGMHYETWHFTAVCNTVKLEELNERIKGAFA---------KSDDKHLRE----R--------------------------GHSETYCCYYHAPTLVIVSNEPKQWWAGMDCACAIENMFLAATSLGIASCWINQLGTTCDDPEVRAYLTSLGVPENHKVYGCVALGYKAE---GALLKEKTVKAGTITI---------


General information:
TITO was launched using:
RESULT:

Template: 3EK3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -80812 for 1272 contacts (-63.5/contact) +
2D Compatibility (PS) -18949 + (NN) -14583 + (LL) 8308
1D Compatibility (HY) -6400 + (ID) 1200
Total energy: -113636.0 ( -89.34 by residue)
QMean score : 0.343

(partial model without unconserved sides chains):
PDB file : Tito_3EK3.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3EK3-query.scw
PDB file : Tito_Scwrl_3EK3.pdb: