Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRSPNLEKEETEIIETLLVREKMRLCPLYWRILAFLIDSLLVAFLLSDLLRACAFLHSLYWLTNPIYYSAFVVMGFIILYGVYEIFFVCLCKMSLAKLVFRIKIID---IYLADC--------PSRAILLKRLGLKIVVFLCP-FLWFVVFKNPYHRAWHEEKSKSLLVLF
3GW9 Chain:A ((6-95))
----------------------------------------------------------------PVYPVTVPILGHIIQFGKSPLGFMQECKRQLKSGIFTINIVGKRVTIVGDPHEHSRFFLPRNEVLSPR---EVYSFMVPVFGEGVAYAAPYPRMREQLNFLAEELTI
General information:
TITO was launched using:
RESULT:
Template:
3GW9.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -55371 for 408 contacts (-135.7/contact) +
2D Compatibility (PS) -7506 + (NN) 4161 + (LL) 6940
1D Compatibility (HY) -4800 + (ID) 1200
Total energy: -57776.0 ( -141.61 by residue)
QMean score : 0.103
(partial model without unconserved sides chains):
PDB file :
Tito_3GW9.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3GW9-query.scw
PDB file :
Tito_Scwrl_3GW9.pdb
: