Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSITSTDICQAADALKGFVGFNRK---TGRYIVRFSEDSFGMDVAD-------DSITPTSEFVWSSVRDDVMRLGREQLQILLEQNINERLNIGEPLLVYLRRQDLPEITAQRQLR
1PEM Chain:A ((518-577))
---------------KTFAGFAQSRYASGDYFTQYLQDDWQPKTAKVRALFARSGITLPTREMWLKLRDDVMRYGIYNQNLQAVPPTGSISYINHATSSIHPIVAKIEIRKEGKTG
General information:
TITO was launched using:
RESULT:
Template:
1PEM.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -3803 for 208 contacts (-18.3/contact) +
2D Compatibility (PS) -5257 + (NN) -182 + (LL) 1296
1D Compatibility (HY) -3200 + (ID) 900
Total energy: -12046.0 ( -57.91 by residue)
QMean score : 0.219
(partial model without unconserved sides chains):
PDB file :
Tito_1PEM.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1PEM-query.scw
PDB file :
Tito_Scwrl_1PEM.pdb
: