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



Input alignment information:
Query sequenceMLAQFTPSALADLANCVLRIPLALQQPSSVAMTLPSLTSFMPHFGAPALLLLQLLAALPATAAETDATPLRFSVMESWSMPLVRLQRGQPIDGIVYDITRSLARQVGRKALYHPYPRGRIEQAMNAGEIDVRCYISPAWLSHDFPGYRWSVALLVQRDILVAREGFA---PIPEALPAQRIGTVL--GYSYPR-LQALFDIGRLRRDDARTQDLVLEKLRAGRYRYAVSHQLSLHWSNRQAPGQPPLQEAAQLEETAVSCMVRDSAEVPVEAILKTFEEMKRSGEIEEILQRYR
3K4U Chain:A ((3-227))-----------------------------------------------------------------LRGELRVGLE-PGYLPFEMKDKKGNVIGFDVDLAREMAKAMGVKLKLVPTSWDGLIPGLVTEKFDIII-SGMTISQERNLRVNFVEPYIVVGQSLLVKKGLEKGVKSYKDLDKPELTLVTKFGVSAEYAAKRLFK--NAKLKTYDTEAEAVQEVLNGKADMFIFDLPFNVAFMAQKGQGYLVHLDTSLTYEPLGWAIKKGDPDFLNWLNHFLAQIKHDGSYDELYERWF


General information:
TITO was launched using:
RESULT:

Template: 3K4U.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -125441 for 1723 contacts (-72.8/contact) +
2D Compatibility (PS) -23171 + (NN) -9575 + (LL) 5944
1D Compatibility (HY) -9200 + (ID) 1400
Total energy: -162843.0 ( -94.51 by residue)
QMean score : 0.492

(partial model without unconserved sides chains):
PDB file : Tito_3K4U.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3K4U-query.scw
PDB file : Tito_Scwrl_3K4U.pdb: