Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MDELKKLAGVTAAKYVKNGMIVGLGTGSTAYFFVEEIGRRVKE-EGLQVVGVTTSNRTTEQARGLGIPLKSADDIDVIDVTVDGADEVDPDFNGIKGGGGALLMEKIVATPTKEYIWVVDESKLVETLGAFKLPVEVVRYGSERLFRVFKSKGYCPSFRETEGDRFITDMGNYIIDLDLKKIEDPKQLANELDHTVGVVEHGLFNSMVNKVIVAGKNGLDILEK
3ENW Chain:A ((21-226))
-DEMKKAAGWAALKYVEKGSIVGVGTGSTVNHFIDALGTMSEEIKG----AVSSSVASTEKLEALGIKIFDCNEVASLDIYVDGADEINADREMIKGGGAALTREKIVAAIADKFICIVDGTKAVDVLGTFPLPVEVIPMARSYVARQLVKLGGDPCYREG----VITDNGNVILDVYGMKITNPKQLEDQINAIPGVVTVGLFAHRGADVVITGTPEGAKIEE
General information:
TITO was launched using:
RESULT:
Template:
3ENW.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -74806 for 1781 contacts (-42.0/contact) +
2D Compatibility (PS) -21679 + (NN) -4389 + (LL) 844
1D Compatibility (HY) -14400 + (ID) 4450
Total energy: -118880.0 ( -66.75 by residue)
QMean score : 0.516
(partial model without unconserved sides chains):
PDB file :
Tito_3ENW.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3ENW-query.scw
PDB file :
Tito_Scwrl_3ENW.pdb
: