Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPLSDHEQRMLDQIESALYAEDPKFASSVRGGGFRAPTARRRLQGAALFII---GLGMLVSGVAFKETMIGSFPILSVFGFVVMFGGVVYAITGPRLSGRMDRGGSAAGASRQRRTKGAGGSFTSRMEDRFRRRFDE
2NYN Chain:A ((174-230))
----------LSYITGSLIGLDPSFKVDFNGKEMDAPTALRQLNLSPLTLLPKEGLAMM------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
2NYN.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -3420 for 266 contacts (-12.9/contact) +
2D Compatibility (PS) -4748 + (NN) 548 + (LL) 4768
1D Compatibility (HY) -5200 + (ID) 850
Total energy: -8902.0 ( -33.47 by residue)
QMean score : 0.178
(partial model without unconserved sides chains):
PDB file :
Tito_2NYN.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2NYN-query.scw
PDB file :
Tito_Scwrl_2NYN.pdb
: