Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKKILIVDDEKPISDIIKFNLTKEGYETATAFDGREALVQYAEFQPDLIILDLMLPELDGLEVAKEVRKTSHIPIIMLSAKDSEFDKVIGLEIGADDYVTKPFSNRELLARVKAHLRRTENIETAVAEESAQNASSDITIGELQILPDAFIAKKRGEEIELTHREFELLHHLATHIGQVMTREHLLETVWGYDYFGDVRTVDVTVRRLREKIEDTPGRPEYILTRRGVGYYMKSYE
1NXW Chain:A ((2-119))
-KKILIVDDEKPISDIIKFNMTKEGYEVVTAFNGREALEQFEAEQPDIIILDLMLPEIDGLEVAKTIRKTSSVPILMLSAKDSEFDKVIGLELGADDYVTKPFSNRELQARVKALLRRS---------------------------------------------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
1NXW.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -67342 for 953 contacts (-70.7/contact) +
2D Compatibility (PS) -12964 + (NN) -9951 + (LL) 9364
1D Compatibility (HY) -14800 + (ID) 4900
Total energy: -100593.0 ( -105.55 by residue)
QMean score : 0.651
(partial model without unconserved sides chains):
PDB file :
Tito_1NXW.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1NXW-query.scw
PDB file :
Tito_Scwrl_1NXW.pdb
: