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



Input alignment information:
Query sequenceMLGQPTRAQLAALVDHTLLKPETTRADVAALVAEAAELGVYAVCVSPSMVPVAVQAG-GVRVAAVTGFPSGKHVSSVKAHEAAAALASGASEIDMVIDIGAALCGDIDAVRSDIEAVRAAAAGAVLKVIVESAVLLGQSNAHTLVDACRAAEDAGADFVKTSTGCHPAGGATVRAVELMAETVGPRLGVKASGGIRTAADAVAMLNAGATRLGLSGTRAVLDGLS
3NG3 Chain:A ((7-226))----PTRAQLAAFVDHTLLKPEATAADVAALVTEAAELGVYAVCVSPPMVPAAVQAGA--RVASVAGFPSGKHVSAVKAHEAALAVASGAAEIDMVIDVGAALAGDLDGVRADIAAVRGAVGGAVLKVIVESSALLALADEHTLVRVCRAAEDAGADFVKTSTGFHPSGGASVRAVALMAEAVGGRLGVKASGGIRTAADALAMLDAGATRLGLSGTRAVLDGL-


General information:
TITO was launched using:
RESULT:

Template: 3NG3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -154621 for 1981 contacts (-78.1/contact) +
2D Compatibility (PS) -24986 + (NN) -19330 + (LL) 324
1D Compatibility (HY) -23600 + (ID) 8950
Total energy: -231163.0 ( -116.69 by residue)
QMean score : 0.622

(partial model without unconserved sides chains):
PDB file : Tito_3NG3.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3NG3-query.scw
PDB file : Tito_Scwrl_3NG3.pdb: