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



Input alignment information:
Query sequenceMIVGEQEARALIKPRPKSSHKGDYGSVLLIGGFYPYGGAIIMAALACVKTGAGLVTVATQSCNIPSLHSQLPEVMAFDSDDYKWLEKSIVQSDVIVIGPGLGVSESSRKILNQTMEKIQSHQSVIIDGSALTLLSEGAFPQTKAKNLVLTPHQKEWERLSGIAVSQQTKENTQTALKSFPKGTILVAKSSHTRIFQDLDEKEIIVGGPYQ--------ATGGMGDTLCGMIAGMLAQFKEASPLDKVSVGVYLHSAIAQELSKEAYVVLPTTISDEIPKEMARLSK
2R3E Chain:A ((31-286))----------VITQRPSDSYKSNFGRVVLIGGNRQYGGAIIMSTEACINSGAGLTTVITDVKNHGPLHARCPEAMVVGFEETVLLTNVVEQADVILIGPGLGLDATAQQILKMVLAQHQKQQWLIIDGSAITLFSQGNFSLTYPEKVVFTPHQMEWQRLSHLPIEQQTLANNQRQQAKL--GSTIVLKSHRTTIFH--------AGEPFQNTGGNPGMATGGTGDTLAGIIAGFLAQFKPT--IETIAGAVYLHSLIGDDLAKTDYVVLPTKISQALPTYMKKYAQ


General information:
TITO was launched using:
RESULT:

Template: 2R3E.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -194555 for 2175 contacts (-89.5/contact) +
2D Compatibility (PS) -26598 + (NN) -8444 + (LL) 1608
1D Compatibility (HY) -21600 + (ID) 5950
Total energy: -255539.0 ( -117.49 by residue)
QMean score : 0.582

(partial model without unconserved sides chains):
PDB file : Tito_2R3E.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2R3E-query.scw
PDB file : Tito_Scwrl_2R3E.pdb: