Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRKKLKWLSFLLGFIILLFLFKYQFSNNDSWKPWSLPLSGKIIYLDPGHGGPDGGAVGG-KLLEKDVTLEVAFRVRDYLQEQGALVIMTRESDTDLAPEGTKGYSRRKAEDLRQRVKLINHSEAELYISIHLNAIPS-QKWSGAQSFYYGKYAENEKVAKYIQDELRRNL-E-NTTRKAKRIHGIYLMQNVTKPGALIEVGFLSNPSEATLLGKPKYQDKVASSIYKGILRYFTEKGDPPE
5EMI Chain:A ((3-180))
--------------------------------------GKLLVVIDPGHGGKDSGAPGLGGLLEKDVILPIGKRVAAILEQHGVQAVLTRDADFFV--------------ELQGRVEIAERVNATAFVSIHANSVDNRPDVNGLEVYYYDS---GYALAEVVRNTILQNIDTIKNRGTRK-A-RFYVLRKSSMPSILVETGYMTGREDNPRLASREYQNQMAEAIARGILKYLQR------
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) -80696 for 1523 contacts (-53.0/contact) +
2D Compatibility (PS) -19014 + (NN) -9217 + (LL) 3740
1D Compatibility (HY) -14000 + (ID) 2600
Total energy: -121787.0 ( -79.97 by residue)
QMean score : 0.604
(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
: