Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRLLVLFCCLWLLPGVASAAPSVGEIRVVSETWTRYTQEDGRGVAWDLLRAVYEPAGVRLRIANEP-YTRAVGLVLRGEADAWV-GAYRGEIDE--ALYPRWPYDVDPIAVLSLKDN-PPPPLEGLSRFRLSWMRGYAFARYFPT-LTPHSELQRRTSALPMLLNHRVDYFIDSRPELEEMLAGAGALAAEYRI--TDVTRLPLYLGFSDSPRGRELLALFDRRMRQLHASGELERIFARWNWPYAPLKAILPPKE
2PYY Chain:A ((4-223))
------------------------PLLVATRVIPPFVLSNLSGFSIDLWRSIATQIGIESKLIEYSSVPELISAIKDNKVNLGIAAISITAEREQNFDFSL-PIFASGLQIMVRN--GDIRSIDDLPGKVVATTAGSTAATYLREHHISVLEVPKIEEAYKALQTKKADAVVFDAPVLLFYAANEG--KGKVEIVGSILREESYGIILPNN---SPYRKPINQALLNLKENGTYQSLYDKWFDP------------
General information:
TITO was launched using:
RESULT:
Template:
2PYY.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -126984 for 1649 contacts (-77.0/contact) +
2D Compatibility (PS) -22891 + (NN) -14916 + (LL) 2948
1D Compatibility (HY) -7600 + (ID) 1250
Total energy: -170693.0 ( -103.51 by residue)
QMean score : 0.341
(partial model without unconserved sides chains):
PDB file :
Tito_2PYY.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2PYY-query.scw
PDB file :
Tito_Scwrl_2PYY.pdb
: