Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPAVIGVIMGSTSDWDTMKKACDVLDELEIAYEKKVVSAHRTPDLMFQYAEQARERGLKIIIAGAGGAAHLPGMVAAKTTLPVIGVPIKSKALNGMDSLLSIVQMPGGVPVATVAIGESGAVNAGLLAAQILSITDDAITNRLQKRRATLEETVLESSDYLG
3ORS Chain:A ((3-163))
-AMKVAVIMGSSSDWKIMQESCNMLDYFEIPYEKQVVSAHRTPKMMVQFASEARERGINIIIAGAGGAAHLPGMVASLTTLPVIGVPIETKSLKGIDSLLSIVQMPGGIPVATTAIGAAGAKNAGILAARMLSIQNPSLVEKLNQYESSLIQKVEDMQNELQ
General information:
TITO was launched using:
RESULT:
Template:
3ORS.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -122960 for 1319 contacts (-93.2/contact) +
2D Compatibility (PS) -17789 + (NN) -7754 + (LL) 208
1D Compatibility (HY) -18000 + (ID) 4850
Total energy: -171145.0 ( -129.75 by residue)
QMean score : 0.645
(partial model without unconserved sides chains):
PDB file :
Tito_3ORS.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3ORS-query.scw
PDB file :
Tito_Scwrl_3ORS.pdb
: