Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MASHEHYYVPAQSKWPIIASIGLLVTVFGLGTWF--NDLTAGHKESHGPWIFFVGGLIIAYMLFGWFGNVIRESR-AGLYSAQMDRSFRWGMSWFIFSEVMFFAAFFGALFYVRHFAGPWLGGEGAKGVAHMLWPNFQYSWPLLQTPDPKLFPPPSAVIEPWKLPLINTILLVTSSFTVTFAHHALKKNKRGPLKAWLALTVLLGIAFLILQAEEYVHAYNELGLTLGAGIYGSTFFMLTGFHGAHVTLGALILGIMLIRILRGHFDAEHHFGFEAASWYWHFVDVVWIGLFIFVYVI
2DYR Chain:C ((8-257))
------YHMVNPSPWPLTGALSALLMTSGLTMWFHFNSMT----------LLMIGLTTNMLTMYQWWRDVIRESTFQGHHTPAVQKGLRYGMILFIISEVLFFTGFFWAFYHSSLAPTPELGG----------------CWP----------PTGIHPLNPLEVPLLNTSVLLASGVSITWAHHSLMEGDRKHMLQALFITITLGVYFTLLQASEYY----EAPFTISDGVYGSTFFVATGFHGLHVIIGSTFLIVCFFRQLKFHFTSNHHFGFEAAAWYWHFVDVVWLFLYVSIYWW
General information:
TITO was launched using:
RESULT:
Template:
2DYR.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -228391 for 1771 contacts (-129.0/contact) +
2D Compatibility (PS) -25511 + (NN) -11453 + (LL) 2312
1D Compatibility (HY) -28800 + (ID) 5200
Total energy: -297043.0 ( -167.73 by residue)
QMean score : 0.281
(partial model without unconserved sides chains):
PDB file :
Tito_2DYR.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2DYR-query.scw
PDB file :
Tito_Scwrl_2DYR.pdb
: