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



Input alignment information:
Query sequenceMSPKVTKEHKDKRQAEILEAAKTVFKRKGFELTTMKDVVEESGFSRGGVYLYFSSTEEMFRRIIETGLDEGLRKLDKSAEHQSVWASISSYLDEL--TEGLRDVADTLAPVQFEYLVTAWRNEERRQYLEKRYDLFVERFSRLLQKGIDQGEFQPVQPLATIAKFFLNMNDGIIQNALYFDEEKADVSGLAESAKLYLKTVLQADEK
3CRJ Chain:A ((10-198))-------RTFSDQTEEIMQATYRALREHGYADLTIQRIADEYGKSTAAVHYYYDTKDDLLAAFLDYLLERFVDSIHDVE-TTDPEARLNLLLDELLVKPQ---ENPDLSVALLEMRSQAPYKEAFSDRFRQNDEYVRYMLKAVINHGIDEGVFT-DVDAEHVTRSLLTIIDGARTRAVMLD-DTEELETARQTASEYADAML-----


General information:
TITO was launched using:
RESULT:

Template: 3CRJ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 675 -80477 -119.22 -430.36
target 2D structure prediction score : 0.77
Monomeric hydrophicity matching model chain A : 0.71

3D Compatibility (PKB) : -119.22
2D Compatibility (Sec. Struct. Predict.) : 0.77
1D Compatibility (Hydrophobicity) : 0.71
QMean score : 0.566

(partial model without unconserved sides chains):
PDB file : Tito_3CRJ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3CRJ-query.scw
PDB file : Tito_Scwrl_3CRJ.pdb: