Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRKEKTSQLVQLAIVTAISIVLGMFISIPTPTGFLTLLDAG-------IFFAAFYFGKKEGAVVGALAGFLIDLLKGYPNWMFFSLLIHGAQGYLAGLPGRRRLLGLISATLVMVLGYAIASGLMYGWGAVLPDIPGNIMQNMVGMVVGFALNKSLERVKK
3V2Y Chain:A ((417-461))
-----------VALLKTVIIVLSVFIACWAPLFILLLLDVGCKVKTCDILFRAEYFLVLAVLNSGTNPIIYTLTNKEMRRAFIRIMGRPL-----------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
3V2Y.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -13717 for 158 contacts (-86.8/contact) +
2D Compatibility (PS) -3670 + (NN) 2569 + (LL) 5972
1D Compatibility (HY) -7600 + (ID) 850
Total energy: -17296.0 ( -109.47 by residue)
QMean score : -0.224
(partial model without unconserved sides chains):
PDB file :
Tito_3V2Y.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3V2Y-query.scw
PDB file :
Tito_Scwrl_3V2Y.pdb
: