Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MASKPQPIAAANWKCNGSESLLVPLIETLNAATFDHDVQCVVAPTFLHIPMTKARLTNPKFQIAAQNAITRSGAFTGEVSLQILKDYGISWVVLGHSERRLYYGETNEIVAEKVAQACAAGFHVIVCVGETNEEREAGRTAAVVLTQLAAVAQKLSKEAWSRVVIAYEPVWAIGTGKVATPQQAQEVHELLRRWVRSKLGTDIAAQLRILYGGSVTAKNARTLYQMRDINGFLVGGASLKPEFVEIIEATK
2Y63 Chain:A ((3-251))
--AKPQPIAAANWKCNGTTASIEKLVQVFNEHTISHDVQCVVAPTFVHIPLVQAKLRNPKYVISAQNAIAKSGAFTGEVSMPILKDIGVHWVILGHSERRTYYGETDEIVAQKVSEACKQGFMVIACIGETLQQREANQTAKVVLSQTSAIAAKLTKDAWNQVVLAYEPVWAIGTGKVATPEQAQEVHLLLRKWVSENIGTDVAAKLRILYGGSVNAANAATLYAKPDINGFLVGGASLKPEFRDIIDATR
General information:
TITO was launched using:
RESULT:
Template:
2Y63.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -190369 for 2135 contacts (-89.2/contact) +
2D Compatibility (PS) -27086 + (NN) -10535 + (LL) 352
1D Compatibility (HY) -28400 + (ID) 8550
Total energy: -264588.0 ( -123.93 by residue)
QMean score : 0.823
(partial model without unconserved sides chains):
PDB file :
Tito_2Y63.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2Y63-query.scw
PDB file :
Tito_Scwrl_2Y63.pdb
: