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



Input alignment information:
Query sequenceMNYKTIKSDGIVEEEIKKSRFICHLKRVESEEEGRNYITQIKKAHYKANHSCSAMVIGEKGDIKRSSDDGEPSGTAGIPMLTVLEKQGLTNVVAVVTRYFGGIKLGAGGLIRAYSGSVANTIKEIGVV------EVKEQIGIRIQLTYPQYQTFDNFLKEHHLQEFETEFLEAVTC---KIYVDPKEFEHTITNLTEFYQGKALLTEEGSQIVEIPFKAETDK----
2CL3 Chain:A ((21-227))------GNKYIQQTKPLTLERTINLYPLTN------YTFGTKEPLYEKDSS-------VAARFQRMREEFDKIGMRRTVEGVLIVHEHRLPHVLLLQLGTTFFKL-PGGELNPGEDEVEGLKRLMTEILGRQDWVIDDCIGNWWRPNFEP--PQYPYIPAHITKPKEHKKLFLVQLQEKALFAVPKNYKLVAAPLFELYDNAPGY---GPIISSLPQLLSRFNFIYN


General information:
TITO was launched using:
RESULT:

Template: 2CL3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -21974 for 1245 contacts (-17.6/contact) +
2D Compatibility (PS) -19645 + (NN) 3667 + (LL) 1604
1D Compatibility (HY) -3200 + (ID) 1400
Total energy: -40948.0 ( -32.89 by residue)
QMean score : 0.194

(partial model without unconserved sides chains):
PDB file : Tito_2CL3.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2CL3-query.scw
PDB file : Tito_Scwrl_2CL3.pdb: