Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRKKLKWLSFLLGFIILLFLFKYQFSNNDSWKPWSLPLSGKIIYLDPGHGGPDGGAVGG--KLLEKDVTLEVAFRVRDYLQE-QGALVIMTRESDTDLAPEGTKGYSRRKAEDLRQRVKLINHSEAELYISIHLNAIPSQKWSGAQSFYYGKYAENEKVAKYIQDELRRNLE-NTTRKAKRIHGIYLMQNVTKPGALIEVGFLSNPSEATLLGKPKYQDKVASSIYKGILRYFTEKGDPPE
1JWQ Chain:A ((2-178))
----------------------------------------KVVVIDAGHGAKDSGAVGISRKNYEKTFNLAMALKVESILKQNPKLEVVLTRSDDTFL--------------ELKQRVKVAENLKANVFVSIHANSSGSSASNGTETYYQRSA--SKAFANVMHKYFAPATGLTDRGIRYG--NFHVIRETTMPAVLLEVGYLSNAKEEATLFDEDFQNRVAQGIADGITEYLDV------
General information:
TITO was launched using:
RESULT:
Template:
1JWQ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -74389 for 1526 contacts (-48.7/contact) +
2D Compatibility (PS) -18739 + (NN) -10090 + (LL) 3552
1D Compatibility (HY) -12400 + (ID) 2750
Total energy: -114816.0 ( -75.24 by residue)
QMean score : 0.527
(partial model without unconserved sides chains):
PDB file :
Tito_1JWQ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1JWQ-query.scw
PDB file :
Tito_Scwrl_1JWQ.pdb
: