Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MDIEKISFSLISLAGDSFSKLIEALQAAKESDSELVEQLLKEADDLMIEAHKVQTEMLIQETRGEQANFSVLLVHAQDTLMNTILASTLIREMIEMHQEIKTLRKEEEK
1WCR Chain:A ((2-102))
EELEEVVMGLIINSGQARSLAYAALKQAKQGDFAAAKAMMDQSRMALNEAHLVQTKLIEGDAGEGKMKVSLVLVHAQLHLMTSMLARELITELIELHEKLK--------
General information:
TITO was launched using:
RESULT:
Template:
1WCR.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -33988 for 686 contacts (-49.5/contact) +
2D Compatibility (PS) -11271 + (NN) -9999 + (LL) 768
1D Compatibility (HY) -7600 + (ID) 1650
Total energy: -63740.0 ( -92.92 by residue)
QMean score : 0.662
(partial model without unconserved sides chains):
PDB file :
Tito_1WCR.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1WCR-query.scw
PDB file :
Tito_Scwrl_1WCR.pdb
: