Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRKKLKWLSFLLGFIILLFLFKYQFSNNDSWKPWSLPLSGKI-IYLDPGHGGPDGGAVG-GKLLEKDVTLEVAFRVRDYLQEQGALVIMTRESDTDLAPEGTKGYSRRKAEDLRQRVKLINHSEAELYISIHLNAIPSQKWSGAQSFYYGKYAENEKVAKYIQDELRRNLENTTRKAKRIHGIYLMQNVTKPGALIEVGFLSNPSEATLLGKPKYQDKVASSIYKGILRYFTEKGDPPE
5EMI Chain:A ((2-178))
--------------------------------------SGKLLVVIDPGHGGKDSGAPGLGGLLEKDVILPIGKRVAAILEQHGVQAVLTRDADFFV--------------ELQGRVEIAERVNATAFVSIHANSVDNRPDVNGLEVYY--YDSGYALAEVVRNTILQNIDTIKNRGTRKARFYVLRKSSMPSILVETGYMTGREDNPRLASREYQNQMAEAIARGILKYL--------
General information:
TITO was launched using:
RESULT:
Template:
5EMI.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -85171 for 1522 contacts (-56.0/contact) +
2D Compatibility (PS) -18897 + (NN) -8732 + (LL) 3304
1D Compatibility (HY) -13600 + (ID) 2800
Total energy: -125896.0 ( -82.72 by residue)
QMean score : 0.599
(partial model without unconserved sides chains):
PDB file :
Tito_5EMI.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-5EMI-query.scw
PDB file :
Tito_Scwrl_5EMI.pdb
: