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



Input alignment information:
Query sequenceMLNRSTDTKRKEMIELKGPEICTDRSRENLIVCLHGRGSSG-NNFVHLAK-----VMSK---SLPNSCFV-APNAPSKREIGNGYQWFSL-EDRSEEVLYNGVKNAASIVNHFIDTKLKEFSLKDTQLSLVGFSQGAMLAIHTALTRPQCCASVVAYSGKFLSPSRVAPKIKSRPNVCVIHGDADNVVPFSFFDLTVKALKENGVNVEGYPIRTLGHLINKEGIKLGVEFIKKNFKK
3DOH Chain:A ((176-338))-----------------------------LVVFLHGAGERGTDNYLQVAGNRGAVVWAQPRYQVVHPCFVLAPQCPPNS------SWSTLFTDR--ENPFNPEKPLLAVIK-IIRKLLDEYNIDENRIYITGLSMGGYGTWTAIMEFPELFAAAIPICGGG-DVSKVE-RIKDIP-IWVFHAEDDPVVPVENSRVLVKKLAEIGGKVRYTEYEKGFMEKHGWDPHGSWIPTYENQEA


General information:
TITO was launched using:
RESULT:

Template: 3DOH.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -101376 for 1173 contacts (-86.4/contact) +
2D Compatibility (PS) -16312 + (NN) -6166 + (LL) 1768
1D Compatibility (HY) -14400 + (ID) 2400
Total energy: -138886.0 ( -118.40 by residue)
QMean score : 0.458

(partial model without unconserved sides chains):
PDB file : Tito_3DOH.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3DOH-query.scw
PDB file : Tito_Scwrl_3DOH.pdb: