Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKILTVEDDKLIREGISEYLSEFGYTVIQAKDGREALSKFNSD-INLVILDIQIPFINGLEVLKEIRKKSNLPILILTAFSDEEYKIDAFTNLVDGYVEKPFSLPVLKARIDSLIKKNFGHLEKFEYKNLSVNFNSYTAKINDEKIDVNAKELEILKCLLDNDGQVLTRMQIIDYVWKDSEEIPYDRVVDVYIKELRKKLQLDCITTIRNVGYKLERK
2A9O Chain:A ((3-118))
-KILIVDDEKPISDIIKFNMTKEGYEVVTAFNGREALEQFEAEQPDIIILDLMLPEIDGLEVAKTIRKTSSVPILMLSAKDSEFDKVIGLELGADDYVTKPFSNRELQARVKALLRR-----------------------------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
2A9O.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -101108 for 933 contacts (-108.4/contact) +
2D Compatibility (PS) -12545 + (NN) -5369 + (LL) 7980
1D Compatibility (HY) -9200 + (ID) 2500
Total energy: -122742.0 ( -131.56 by residue)
QMean score : 0.717
(partial model without unconserved sides chains):
PDB file :
Tito_2A9O.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2A9O-query.scw
PDB file :
Tito_Scwrl_2A9O.pdb
: