Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MEKNWYVVHTYSGYENKVKANLEKRVESMGMSDKIFRVIVPEEEETEVKNGKTKTIKRKVFPGYVLVEIVMTDDSWYVVRNTPGVTGFVGSAGSGSKPTPLLPEEADRILKSMGMVEKRAEADFEIGETVMVKEGPFADFSGKVDEMDNDKGKAKVMVNMFGRETPVEVDFNQIEKL
2OUG Chain:A ((2-156))
--QSWYLLYCKRGQLQRAQEHLERQ---------AVNCLAPMITLEKIVRGKRTAVSEPLFPNYLFVEFDPEVIHTTTINATRGVSHFVRF---GASPAIVPSAVIHQLSV---------------YKKVIITEGAFEGFQAIFTEPDGEA-RSMLLLNLINKEIKHSVKN------
General information:
TITO was launched using:
RESULT:
Template:
2OUG.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -30930 for 1000 contacts (-30.9/contact) +
2D Compatibility (PS) -15521 + (NN) -8329 + (LL) 2576
1D Compatibility (HY) -8000 + (ID) 1500
Total energy: -61704.0 ( -61.70 by residue)
QMean score : 0.310
(partial model without unconserved sides chains):
PDB file :
Tito_2OUG.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2OUG-query.scw
PDB file :
Tito_Scwrl_2OUG.pdb
: