Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSPGSRRASPQSAREVVELDRDEAMRLLASVDHGRVVFTRAALPAIRPVNHLVVDGRVIGRTR--LTAKVSVAVRSSADAGVVVAYEADDLDPR---------RRTGWSVVVTGLATEVSDPEQVARY-QRLLH-----PWV--------NMAMDTVVAIEPEIVTGIRIVADSRTP
2FUR Chain:A ((17-166))
---------------RASYSDEDLVAMLDRNFTCTVSFIDGGIPYAIPMMLASEGKTIYLHGSMKSRIYGILKT------GQLIAISLLEINGIVLAKEIKNNSINYVSALIFGRPYEIDDTEKKIEVFRLLTEKLVKGRWDNSIKPSYEDLNGVFVFAVKPETFSMKART------
General information:
TITO was launched using:
RESULT:
Template:
2FUR.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -68152 for 835 contacts (-81.6/contact) +
2D Compatibility (PS) -14151 + (NN) -5682 + (LL) 764
1D Compatibility (HY) -2000 + (ID) 900
Total energy: -90121.0 ( -107.93 by residue)
QMean score : 0.476
(partial model without unconserved sides chains):
PDB file :
Tito_2FUR.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2FUR-query.scw
PDB file :
Tito_Scwrl_2FUR.pdb
: