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



Input alignment information:
Query sequenceMLKKYLKAAIYLSLLIYIYISVFSYSYKDISLNTVTDKEVTNLGGIVGSYLADILVQFLGLTSITVATTIICFLIFRPSKRLLKVLYSVLINLGICAMLPQLSLGITARYMHSGIIGNILINNCPFYIFIIATSTGIVGLIGWKRTIYLLFLLYKKVASLLAKVLFFRLYKAAEYPTPPLVVEEKHRAQITTRQQPKERQKKVIGEIFESSSEFKFPSIHLLSKAEESLQRKRLNEMESNKNLS-LLEQVLSDFGVQGKVISVCYGPVVTLYKLEPQAGTKSARVIGLADDIARSMSALSARI-SIIRGQNAMGIELPNKEREIVMLRDLLESLEYQNANLNLPIALGKEISGKPVIADLAKMPHLLVAGTTGSGKSVAINTMILSLIYRLSPDACKMIMIDPKMLELSIYDAIPHLITPVVTEPKKAVIALKWIVKEMENRYRMMSYLNVRNVINYNQKITEAINSGIELERVVQVGFNSTTGKPLFEK-----MPIKMETFSYIVVIVDEMADLMLVAGKEIECSIQRLAQMARAAGIHIIMATQRPSVDVITGVIKANFPTRISFAVTSKIDSRTILGEQGAEQLLGMGDMLYMASG-GKIIRVHGPFVSDEEVQNIVDHLKMQGEPNYMEEI-TKEDENSSAELKGETEGEENDLYKQAVAIIQRDQKVSTSYIQRQLRIGYNRAANIVERTEKEGIISAPNYLGKREILVE
2IUT Chain:B ((70-478))-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------LPPLSLLDPAE---VKQKSYSPESLEAMSRLLEIKLKEFGVEVSVDSVHPGPVITRFEIQPAAGVKVSRISNLAKDLARSLAVISVRVVEVIPGKTTVGIEIPNEDRQMVRFSEVLSSPEYDEHKSTVPLALGHDIGGRPIITDLAKMPHLLVAGTTGSGKSVGVNAMLLSILFKSTPSEARLIMIDPKMLELSIYEGIPHLLCPVVTDMKEAANALRWSVAEMERRYRLMAAMGVRNLAGFNRKVKDAEEAGTPLT------------DPLFRRESPDDEPPQLSTLPTIVVVVDEFADMMMIVGKKVEELIARIAQKARAAGIHLILATQRPSVDVITGLIKANIPTRIAFQVSSKIDSRTILDQGGAEQLLGHGDMLYLPPGTGLPIRVHGAFVSDDEVHRVVEAWKLRGAPDYIEDILAG-----------------------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 2IUT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -105276 for 3775 contacts (-27.9/contact) +
2D Compatibility (PS) -42249 + (NN) -4633 + (LL) 25624
1D Compatibility (HY) -41200 + (ID) 10750
Total energy: -178484.0 ( -47.28 by residue)
QMean score : 0.563

(partial model without unconserved sides chains):
PDB file : Tito_2IUT.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2IUT-query.scw
PDB file : Tito_Scwrl_2IUT.pdb: