Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequence-------------------------------MVLFLSIFKKSFNDFLSARMLLINLGPILLSLAFFGAIFYYNGGSIVNYCQTLLPQSLNDYAHSQ---------GFFAGVFAWVFKALVYFLIFWIVILL----SLVINIFASIFYTPLVVSYLHQKYYPHVVLEEFGSILFSIKYFLKSLTFMLLFLAVLTPLYFIPFIGVFGVFFSIVPHFLFFKNTMSLDIASMIFNHQSYQNLLKQHRLKHYRFSFFCYLFSLI--PFFNFFATLLQTLMLTHYFFIFKEKEC--------------
3CKJ Chain:A ((15-329))GLRDTRPGDTWLADRSWNRPGWTVAELEAAKAGRTISVVLPALDEEDTIGSVIDSISPLVDGLVD--ELIVLDSGSTDDTEIRAVAAGARVVSREQALPEVPIRPGKGEALWRSLAASRGDIVVFVDSDLINPHPMFVPWLVGPLLTGDGVHLVKSFYRRPGRVTELVARPLLAALRPELGCILQPLGGEYAATRELLTSVPFAPGYGVEIGLLVDTFDRLGLDAIAQVNLGVREHRNRPLAELGAMSRQVIATLLSRCGIPDSGVGLTQFVADGPEGQSYTQHTWPVSLADRPPMQAIRPR


General information:
TITO was launched using:
RESULT:

Template: 3CKJ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -316693 for 1945 contacts (-162.8/contact) +
2D Compatibility (PS) -23715 + (NN) 10800 + (LL) -40
1D Compatibility (HY) 4400 + (ID) 1150
Total energy: -326398.0 ( -167.81 by residue)
QMean score : 0.113

(partial model without unconserved sides chains):
PDB file : Tito_3CKJ.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-3CKJ-query.scw
PDB file : Tito_Scwrl_3CKJ.pdb: