Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
-MSISASEARQRLFPLIEQVNTDHQPVRITSRAGDAVLMSADDYDAWQETVYLLRSPENARRLMEAVARDKAGHSAFTKSVDELREMAGGEE
3HS2 Chain:A ((1-56))
MQSINFRTARGNLSEVLNNVEAGEEVEITRRGREPAVIVSKATFEAYKKAALDAEF------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
3HS2.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -9346 for 288 contacts (-32.5/contact) +
2D Compatibility (PS) -6007 + (NN) -1922 + (LL) 2452
1D Compatibility (HY) -1600 + (ID) 500
Total energy: -16923.0 ( -58.76 by residue)
QMean score : 0.210
(partial model without unconserved sides chains):
PDB file :
Tito_3HS2.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3HS2-query.scw
PDB file :
Tito_Scwrl_3HS2.pdb
: