Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPNYKLTYFNMRGRAEIIRYIFAYLDIQYEDHRIEQADWPEIKSTLPFGKIPILEVDGLTLHQSLAIARYLTKNTDLAGNTEMEQCHVDAIVDTLDDFMSCFPWAEKKQDVKEQMFNELLTYNAPHLMQDLDTYLGGREWLIGNSVTWADFYWEICSTTLLVFKPDLLDNHPRLVTLRKKVQAIPAVANWIKRRPQTKL
3EE2 Chain:A ((2-199))
-PNYKLTYFNMRGRAEIIRYIFAYLDIQYEDHRIEQADWPEIKSTLPFGKIPILEVDGLTLHQSLAIARYLTKNTDLAGNTEMEQCHVDAIVDTLDDFMSCFPWAEKKQDVKEQMFNELLTYNAPHLMQDLDTYLGGREWLIGNSVTWADFYWEICSTTLLVFKPDLLDNHPRLVTLRKKVQAIPAIANWIKRRPQTKL
General information:
TITO was launched using:
RESULT:
Template:
3EE2.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -130749 for 1431 contacts (-91.4/contact) +
2D Compatibility (PS) -21136 + (NN) -8850 + (LL) 208
1D Compatibility (HY) -30800 + (ID) 9850
Total energy: -201177.0 ( -140.58 by residue)
QMean score : 0.757
(partial model without unconserved sides chains):
PDB file :
Tito_3EE2.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3EE2-query.scw
PDB file :
Tito_Scwrl_3EE2.pdb
: