Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MALKLLKKLLFDRPLKNGVILNHQYKIEECLGMGGYGLVYLCTDILAQTPYVLKQLRPTKAKKEKEKVRFQQEIKLLKNIHHPQIPGFIDEFIIDGQAYYVMQFIEGENIEELLFFRKQPFTELMALQLISQLLEIIEYLHDRLIFHSDIRTPNIII----NDGRLCLIDFGLAKQLTPEEMEEIKVRKQDDFFDLGETLLFLLYSQYKGKKKKNGTWLEELTLTKEVTLLLKRLLGIEEEYQHTASIREDLNRAIQSVT
4ONA Chain:A ((22-176))
------------------AIFSDRYKGQRVLGKGSFGEVILCKDKITGQECAVKVISKRQVKQKTDKESLLREVQLLKQLDHPNIMKLYEFFEDKGYFYLVGEVYTGGELFDEIISRKR-FSEVDAARIIRQVLSGITYMHKNKIVHRDLKPENLLLESKSKDANIRIIDFGLS--------------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
4ONA.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -110590 for 1031 contacts (-107.3/contact) +
2D Compatibility (PS) -16418 + (NN) -8889 + (LL) 8616
1D Compatibility (HY) -13600 + (ID) 2350
Total energy: -143231.0 ( -138.92 by residue)
QMean score : 0.478
(partial model without unconserved sides chains):
PDB file :
Tito_4ONA.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4ONA-query.scw
PDB file :
Tito_Scwrl_4ONA.pdb
: