Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSNKYYDSNNIFAQILRGELPCKKVYEDEDVLAFYDKYPDAPVHILVVPKSQYISYDDFIFKASAEEIVGFFKTV-REITYKYNLEKTGYRLVTNCGENGEQVVPHFHMHILGGKRLGKHVNL
1KPC Chain:A ((16-121))
--------DTIFGKIIRKEIPAKIIFEDDRCLAFHDISPQAPTHFLVIPK-KHISQIS-VAEDDDESLLGHLMIVGKKCAADLGLNK-GYRMVVNEGSDGGQSVYHVHLHVLGGRQMHWPPG-
General information:
TITO was launched using:
RESULT:
Template:
1KPC.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -82930 for 726 contacts (-114.2/contact) +
2D Compatibility (PS) -11530 + (NN) -8844 + (LL) 228
1D Compatibility (HY) -8400 + (ID) 2150
Total energy: -113626.0 ( -156.51 by residue)
QMean score : 0.670
(partial model without unconserved sides chains):
PDB file :
Tito_1KPC.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1KPC-query.scw
PDB file :
Tito_Scwrl_1KPC.pdb
: