Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MADEEKLPPGWEKRMSRSSGRVYYFNHITNASQWERPSGNSSSGGKNGQGEPARVRCSHLLVKHSQSRRPSSWRQEKITRTKEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE
3IKG Chain:B ((11-123))
--------------------------------------------------EPARVRCSHLLVKHSQSRRPSSWRQEQITRTQEEALELINGYIQKIKSGEEDFESLASQFSDCSSAKARGDLGAFSRGQMQKPFEDASFALRTGEMSGPVFTDSGIHIILRTE
General information:
TITO was launched using:
RESULT:
Template:
3IKG.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -29022 for 862 contacts (-33.7/contact) +
2D Compatibility (PS) -12084 + (NN) -6311 + (LL) 1004
1D Compatibility (HY) -12000 + (ID) 5550
Total energy: -63963.0 ( -74.20 by residue)
QMean score : 0.450
(partial model without unconserved sides chains):
PDB file :
Tito_3IKG.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3IKG-query.scw
PDB file :
Tito_Scwrl_3IKG.pdb
: