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



Input alignment information:
Query sequenceMGNLNWAILGPGSIAHEFAEGMRG-M-NREIYAVGARSLEKGQAFASQYGIENVYDDFDKMLADPAIDVVYIATPHSNHYEFIMKSLHNGKHVLAEKAITVSSKELNEINVLAKEK-GLIVKEAMTIFHMPLYKKLREIVESGAIGKLKIIQVAFGSAKEKDPKN-RFYNMDLAGGALLDIGTYALSFARYFLSETPDEVLTTMKKF------ETGVDEQSGILLKNNEEELAVVSLSFRAK--MPKRGVIACEEGFITVDEYPRASRATVTHTATGKVEEIE--VGETSKALEYEITAMEESVATG-EN-MTYQLTNDVIAIMSDVRTQWGIKFPFEK
3CEA Chain:A ((6-343))RKPLRAAIIGLGRLGERHARHLVNKIQGVKLVAACALDSNQLEWAKNELGVETTYTNYKDMIDTENIDAIFIVAPTPFHPEMTIYAMNAGLNVFCEKPLGLDFNEVDEMAKVIKSHPNQIFQSGFMRRYDDSYRYAKKIVDNGDIGKIIYMRGYGIDPISGMESFTKFATEADSGGIFVDMNIHDIDLIRWFTGQDPVQAYGLTSNIAAPQLADIGEFETGVAQLKMSDGVIATLIGGRHAAHGNQVELEVMGSNGWVRIGEHPDLNRVTVFNDQGVVRPSLQSFGERFDTAFTDEVQDFVNNVIVGKQPEVTVDDGIKALKIAKACQQSANIGKLVD-


General information:
TITO was launched using:
RESULT:

Template: 3CEA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -173106 for 2686 contacts (-64.4/contact) +
2D Compatibility (PS) -34399 + (NN) -6544 + (LL) 64
1D Compatibility (HY) -9600 + (ID) 2950
Total energy: -226535.0 ( -84.34 by residue)
QMean score : 0.512

(partial model without unconserved sides chains):
PDB file : Tito_3CEA.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3CEA-query.scw
PDB file : Tito_Scwrl_3CEA.pdb: