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



Input alignment information:
Query sequenceMNPREHGKRSIDNETRSALKRQRPAVIWLTGLSGAGKSTIASALELALFEQKKHTFLLDGDDLRLGLCRNLGYSDEDRTENIRRIAEVAKILLEAGLIVIVATISPFSRDRRLSRELIGIEHFIEVFVDTPLSECERRDPKGLYRKARSGKIENFTGIDSIYETPAQPNITID-TLSEDPDLAVKRIISYLETNQPA
3UIE Chain:B ((11-194))---------SVEKVDRQRLLDQKGCVIWVTGLSGSGKSTLACALNQMLYQKGKLCYILDGDNVRHGLNRDLSFKAEDRAENIRRVGEVAKLFADAGIICIASLISPYRTDRDACRSLLPEGDFVEVFMDVPLSVCEARDPKGLYKLARAGKIKGFTGIDDPYEPPLNCEISLGREGGTSPIEMAEKVVGYLDNKGYL


General information:
TITO was launched using:
RESULT:

Template: 3UIE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -90812 for 1477 contacts (-61.5/contact) +
2D Compatibility (PS) -20401 + (NN) -10081 + (LL) 228
1D Compatibility (HY) -15600 + (ID) 4350
Total energy: -141016.0 ( -95.47 by residue)
QMean score : 0.588

(partial model without unconserved sides chains):
PDB file : Tito_3UIE.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3UIE-query.scw
PDB file : Tito_Scwrl_3UIE.pdb: