Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MPLSGEYAPSPLDWSREQADTYMKSGGTEGTQLQGKPVILLTTVGAKTGKLRKTPLMRVEHDGQYAIVASLGGAPKNPVWYHNVVKNPRVELQDGTVTGDYDAREVFGDEKAIWWQRAVAVWPDYASYQTKTDRQIPVFVLTPVRAGG
3R5R Chain:A ((4-112))
----------------------------------KIPVALLTTTGRKTGQPRVNPLYFLRDGGRVIVAASKGGAEKNPMWYLNLKANPKVQVQIKKEVLDLTARDATDEERAEYWPQLVTMYPSYQDYQSWTDRTIPIVVCEP-----
General information:
TITO was launched using:
RESULT:
Template:
3R5R.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -55692 for 795 contacts (-70.1/contact) +
2D Compatibility (PS) -12267 + (NN) -6937 + (LL) 1284
1D Compatibility (HY) -6800 + (ID) 2350
Total energy: -82762.0 ( -104.10 by residue)
QMean score : 0.478
(partial model without unconserved sides chains):
PDB file :
Tito_3R5R.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3R5R-query.scw
PDB file :
Tito_Scwrl_3R5R.pdb
: