Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MAVTVGVICAIPQELAYLRGVLVDAKRQQVAQILFDSGQLDAHRVVLAAAGMGKVNTGLTATLLADRFGCRTIVFTGVAGGLDPELCIGDIVIADRVVQHDFGLLTDERLRPYQPGHIPFIEPTERLGYPVDPAVIDRVKHRLDGFTLAPLSTAAGGGGRQPRIYYGTILTGDQYLHCERTRNRLHHEL-GGMAVEMEGGAVAQICASFDIPWLVIRALSDLAGADSGVDFNRFVGEVAASSARVLLRLLPVLTAC
3EEI Chain:A ((3-233))
-LKTVAVIGAMEQEIELLREMMENVKAVSFGRFSAYEGELAGKRMVLALSGIGKVNAAVATAWIIREFAADCVINTGSAGGLGKGLKVGDVVIGTETAHHDVDVTAFG----YAWGQVPQLPA----RFASDGILIEAAKRAAR-------------TFEGAAVEQGLIVSGDRFVHSSEGVAEIRKHFPEVKAVEMEAAAIAQTCHQLETPFVIIRAVSDSADEKADISFDEFLKTAAANSAKMVAEIVKSL---
General information:
TITO was launched using:
RESULT:
Template:
3EEI.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -213273 for 2128 contacts (-100.2/contact) +
2D Compatibility (PS) -24406 + (NN) -7507 + (LL) 1464
1D Compatibility (HY) -14800 + (ID) 3450
Total energy: -261972.0 ( -123.11 by residue)
QMean score : 0.455
(partial model without unconserved sides chains):
PDB file :
Tito_3EEI.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3EEI-query.scw
PDB file :
Tito_Scwrl_3EEI.pdb
: