Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPNQEKMEKAIYQFLEALGENPDREGLKDTPKRVAKMYIEMFSGLNQDPKEQFT-AVFSENHEEVVIVKDIPFYSMCEHHLVPFYGKAHIAYLPNDGRVTGLSKLARAFEVASKRPQLQERLTAQVAQALEDALAPKGIFVMIEAEHMCMTMRGIKKPGSKTITTVARGLYKDDRYERQEILSLIQKG
1WUR Chain:A ((32-216))
EVDLERLQALAAEWLQVIGEDPGREGLLKTPERVAKAWAFLTRGYRQRLEEVVGGAVFPAEGSEMVVVKGVEFYSMCEHHLLPFFGKVHIGYIPD-GKILGLSKFARIVDMFARRLQVQERLAVQIAEAIQEVLEPQGVGVVVEGVHLCMMMRGVEKQHSRTVTSAMLGVFRENQKTREEFLSHLR--
General information:
TITO was launched using:
RESULT:
Template:
1WUR.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -76623 for 1387 contacts (-55.2/contact) +
2D Compatibility (PS) -20664 + (NN) -11849 + (LL) -184
1D Compatibility (HY) -17200 + (ID) 3900
Total energy: -130420.0 ( -94.03 by residue)
QMean score : 0.613
(partial model without unconserved sides chains):
PDB file :
Tito_1WUR.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1WUR-query.scw
PDB file :
Tito_Scwrl_1WUR.pdb
: