Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
DTSPSQ------------CKEERNLLVNACRPVLYGQNPSADCCQRV----RVSHVECVCPYVSTKTAAIIEVLGV--PKAVKKIEGCGRTVPRKFKCGSITTP
2DBH Chain:A ((1-102))
GSSGSSGSSALSRNGSFITKEKKDTVLRQVRLDPCDLQPIFDDMLHFLNPEELRVIEEI-PQAEDKLDRLFEIIGVKSQEASQTLLDSVYSHLPDLLSGPSSG-
General information:
TITO was launched using:
RESULT:
Template:
2DBH.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -23604 for 494 contacts (-47.8/contact) +
2D Compatibility (PS) -8583 + (NN) -2693 + (LL) -84
1D Compatibility (HY) -1200 + (ID) 750
Total energy: -36914.0 ( -74.72 by residue)
QMean score : 0.441
(partial model without unconserved sides chains):
PDB file :
Tito_2DBH.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2DBH-query.scw
PDB file :
Tito_Scwrl_2DBH.pdb
: