Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MLIVPKEMRDYTIGSGRSLLDIITEYFQELCEKSGFIKKEYRIERNVDNTFVLDRRVNEPAVTNNRKEIS
2A2U Chain:A ((124-146))
----------------KDLSSDIKEKFAKLCEAHGITRDNIIDLTKTDRCL-------------------
General information:
TITO was launched using:
RESULT:
Template:
2A2U.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -3604 for 86 contacts (-41.9/contact) +
2D Compatibility (PS) -2406 + (NN) 32 + (LL) 2464
1D Compatibility (HY) -800 + (ID) 400
Total energy: -4714.0 ( -54.81 by residue)
QMean score : 0.142
(partial model without unconserved sides chains):
PDB file :
Tito_2A2U.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2A2U-query.scw
PDB file :
Tito_Scwrl_2A2U.pdb
: