Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MALKLLKKLLFDRPLKNGVILNHQYKIEECLGMGGYGLVYLCTDILAQTPYVLKQLRPTKAKKEKEKVRFQQEIKLLKNIHHPQIPGFIDEFIIDGQAYYVMQFIEGENIEELLFFRKQPFTELMALQLISQLLEIIEYLHDRLIFHSDIRTPNIII----NDGRLCLIDFGLAKQLTPEEMEEIKVRKQDDFFDLGETLLFLLYSQYKGKKKKNGTWLEELTLTKEVTLLLKRLLGIEEEYQHTASIREDLNRAIQSVT
3I7B Chain:A ((23-179))
-------------------IFSDRYKGQRVLGKGSFGEVILCKDKITGQECAVKVISKRQVKQKTDKESLLREVQLLKQLDHPNIMKLYEFFEDKGYFYLVGEVYTGGELFDEIISRKR-FSEVDAARIIRQVLSGITYMHKNKIVHRDLKPENLLLESKSKDANIRIIDFGLS--------------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
3I7B.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -110432 for 1019 contacts (-108.4/contact) +
2D Compatibility (PS) -16444 + (NN) -9156 + (LL) 8808
1D Compatibility (HY) -14000 + (ID) 2350
Total energy: -143574.0 ( -140.90 by residue)
QMean score : 0.482
(partial model without unconserved sides chains):
PDB file :
Tito_3I7B.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3I7B-query.scw
PDB file :
Tito_Scwrl_3I7B.pdb
: