Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTLLNDIQVWTTACAYDHLIPGRGVGVLLDDGSQVALFRLDDGSVHAVGNVDPFSGAAVMSRGIVGDRGGRAMVQSPILKQAFALDDGSCLDDP---------RVSVPVYPARVTPEGRIQVARVAV
3GKQ Chain:A ((28-142))
-----FRNHWYPVRLSAEVAEASPVPVQL-LGEKVLLNRV-DGVVHAIADRCLHRGV-TLSDKVECY--SKATISCWYHGWTYRWDNGKLVDILTNPTSVQIGRHALKTYPVREEK-GLVFLFVGD-
General information:
TITO was launched using:
RESULT:
Template:
3GKQ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -71642 for 760 contacts (-94.3/contact) +
2D Compatibility (PS) -11842 + (NN) -8119 + (LL) 748
1D Compatibility (HY) -2000 + (ID) 1200
Total energy: -94055.0 ( -123.76 by residue)
QMean score : 0.419
(partial model without unconserved sides chains):
PDB file :
Tito_3GKQ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3GKQ-query.scw
PDB file :
Tito_Scwrl_3GKQ.pdb
: