Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MKLFDYAPLSLAWREFLQSEFKKPYFLEIEKRYLEALKSPKTIFPKSSNLFCAFNLTPPYAVKIILLGQDPYHSTYLENEQELPVAMGLSFSVEKNA-PIPPSLKNIFKELHANLGVPVPCCGDLSAWAKRGMLLLNAILSVEKNQAASHKYIGWEAFSDQILIRLFETTTPLIVVLLGKVAQKKIALIPKNKHIIITAPHPSPL--SRGFLGSGVFTSVQKAYREVYRKDFDFSL
3A7N Chain:A ((51-237))
----------------------------------------RRYLPAGSNVLRAFTF-PFDNVRVLIVGQDPYPTPGH--------AVGLSFSVAPDVRPWPRSLANIFDEYTADLGYPLPSNGDLTPWAQRGVLLLNRVLTVRPSNPASHRGKGWEAVTECAIRALAARAAPLVAILWGRDASTLKPMLAAGNCVAIESPHPSPLSASRGFFGSRPFSRANELLVGMGAEPIDWRL
General information:
TITO was launched using:
RESULT:
Template:
3A7N.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -142151 for 1473 contacts (-96.5/contact) +
2D Compatibility (PS) -19728 + (NN) -9201 + (LL) 4248
1D Compatibility (HY) -14800 + (ID) 3700
Total energy: -185332.0 ( -125.82 by residue)
QMean score : 0.565
(partial model without unconserved sides chains):
PDB file :
Tito_3A7N.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3A7N-query.scw
PDB file :
Tito_Scwrl_3A7N.pdb
: