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



Input alignment information:
Query sequenceMMMKYEAVIIGGGPVGFMLASELAIAGVGTCVIERLEKPVPHSKALTLHPRTLELLEMRGILERFVSKGSKIPTG-HFSMLDTR-LDFSGLDTSCPYTLLLPQSKTEKLLEDHARSLGTEVFRGAEALAVTQNGEAVQTIFKDRDGSVRTITSKFAVGADGAGSTVRKQAKIEFPGTDSTVTAALGDVVL--------LSPPPSGVLSLC-TKEGGVMIVPLSPDRYRVVVISPYRTQTPKDVPVTEEELKADLLRICGTDFGLTDP-SWMSRFGNAARQAKRYRDGRIFLAGDAAHIHFPAGGQGLNVGLQDAMNLGWKLAAAIKGSAPSWLLDSYHDERHPAAEGLLRNTEAQTKLI-DFTQAGLHLRSMMSELLAFPDVNRYVAGQISALDVRY-------EADRTMPPNRLNGARLPDMKLILSDGNSE--RLYSFLQNGTFVLLSLRQEADDHIEVKGLRTVTASLAEPNEKLRNVHTILIRPDGHVAWAVDASAPDCSEVIQKGISRWFSVTSRV
4K5R Chain:B ((28-508))----------------LMLAGELRAGGVGALVLEKLVEPVGHDRAGALHIRTVETLDLRGLLDRFL-EGTQVAKGLPFAGIFTQGLDFGLVDTRHPYTALVPQSRTEALLAEHAREAGAEIRRGHEVTGLRQDAEAVEVTVAGPSGPYR-VRARYAVGCDGGRSTVRRLAGIGFPGTEATVRALIGYVTTPEREVPRRWERTPDGILVLAFPPEGGLG---------RVVVIE-YT-----EGPVTLEDLGAAVARVRGTPLTLTEPVSWLSRFGDASRQAKRYRSGRVLLAGDAAHVHFPIGGQGLNTGLQDAVNLGWKLAARVRGWGSEELLDTYHDERHPVAERVLLNTRAQLALMRPDEQHTTPLRGFVEELLGTDEVNRYFTGMITGTDVRYATFAPAA--RPHPWAGRFAGG------LVLSGPSGEPVPVAELLRSARPLLLDLAGRADLREATRPWSDRVSVVAGEATVEPPAQALLVRPDGYVAWAGSPAA--TADELRASLARWF------


General information:
TITO was launched using:
RESULT:

Template: 4K5R.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 2480 -232476 -93.74 -516.61
target 2D structure prediction score : 0.50
Monomeric hydrophicity matching model chain B : 0.80

3D Compatibility (PKB) : -93.74
2D Compatibility (Sec. Struct. Predict.) : 0.50
1D Compatibility (Hydrophobicity) : 0.80
QMean score : 0.478

(partial model without unconserved sides chains):
PDB file : Tito_4K5R.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-4K5R-query.scw
PDB file : Tito_Scwrl_4K5R.pdb: