Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MAVHLTRIYTRTGDDGTTGLSDMSRVAKTDARLVAYADCDEANAAIGAALALGHPDTQI-TDVLRQIQNDLFDAGADLSTPIVENPKHPPLRIAQSYIDRLEGWCDAYNAGLPALKSFVLPGGSPLSALLHVARTVVRRAERSAWAAVDAHPEGVSVLPAKYLNRLSDLLFILSRVAN---PDGDVLWRPGGDRTAS
3GAJ Chain:A ((8-187))
------KIYTKNGDKGQTRIIGKQILYKNDPRVAAYGEVDELNSWVGYTKSLINSHTQVLSNELEEIQQLLFDCGHDLATP-ADDERHSFKFKQEQPTVWLEEKIDNYTQVVPAVKKFILPGGTQLASALHVARTITRRAERQIVQLMREEQINQDVLI--FINRLSDYFFAAARYANYLEQQPDMLYR--------
General information:
TITO was launched using:
RESULT:
Template:
3GAJ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -67829 for 1317 contacts (-51.5/contact) +
2D Compatibility (PS) -19132 + (NN) -13226 + (LL) 936
1D Compatibility (HY) -10400 + (ID) 3450
Total energy: -113101.0 ( -85.88 by residue)
QMean score : 0.413
(partial model without unconserved sides chains):
PDB file :
Tito_3GAJ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3GAJ-query.scw
PDB file :
Tito_Scwrl_3GAJ.pdb
: