Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MGGTFDPIHYGHLVAASEVADLFDLDEVVFVPSGQ-PWQKGRQVSAAEHRYLMTVIATASNPRFSVSRVDIDRGGPTYTKDTLADLHA-LHPDSELYFTTGADALASIMSWQGWEELFELARFVGVSRPGYELRNEHITSLLGQLAKDA-------------LTLVEIPALAISSTDCRQRAEQSRPLWYLMPDGVVQYVSKCRLYCGACDAGARSTTSLAAGNGL
1YUN Chain:B ((28-230))
FGGTFDPVHIGHMRSAVEMAEQFALDELRLLPNARPPHRETPQVSAAQ-RLAMVERAVAGVERLTVDPRELQRDKPSYTIDTLESVRAELAADDQLFMLIGWDAFCGLPTWHRWEALLDHCHIVVLQRPDAD--SEPPESLRDLLAARSVADPQALKGPGGQITFVWQTPLAVSATQIRALLGAGRSVRFLVPDAVLNYIEAHHLY--------------------
General information:
TITO was launched using:
RESULT:
Template:
1YUN.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -127368 for 1414 contacts (-90.1/contact) +
2D Compatibility (PS) -20057 + (NN) -6954 + (LL) 808
1D Compatibility (HY) -14000 + (ID) 3500
Total energy: -171071.0 ( -120.98 by residue)
QMean score : 0.456
(partial model without unconserved sides chains):
PDB file :
Tito_1YUN.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1YUN-query.scw
PDB file :
Tito_Scwrl_1YUN.pdb
: