Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MNKPII-ALDFQTYEEVETFLAKFSGETLSVKVGMELFYSNGPVIVEKIKQQNHEIFLDLKLHDIPNTVKSAMIGLAKLGVDMVNVHAAGGKKMMEAAKEGLEIGSPSGK-RPKIIAVTQLTSTSETDMQTEQLIKTSLLESVMHYSNLSKQAGLDGVVCSALEAEDIKQQNGADFLRVTPGIRLASDTADDQIRVVTPEKARLIGSSNIVVGRSITRANDPVAAYNQVLKEWNA
1JJK Chain:A ((14-239))
-NSPVVVALDYHNRDDALAFVDKIDPRDCRLKVGKEMFTLFGPQFVRELQQRGFDIFLDLKFHDIPNTAAHAVAAAADLGVWMVNVHASGGARMMTAAREAL---VPFGKDAPLLIAVTVLTSMEASDL-VDLGMTLSPADYAERLAALTQKCGLDGVVCSAQEAVRFKQVFGQEFKLVTPGIRPQGSEAGDQRRIMTPEQALSAGVDYMVIGRPVTQSVDPA----QTLKAINA
General information:
TITO was launched using:
RESULT:
Template:
1JJK.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -89184 for 1883 contacts (-47.4/contact) +
2D Compatibility (PS) -24560 + (NN) -10721 + (LL) 764
1D Compatibility (HY) -13200 + (ID) 5100
Total energy: -142001.0 ( -75.41 by residue)
QMean score : 0.517
(partial model without unconserved sides chains):
PDB file :
Tito_1JJK.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1JJK-query.scw
PDB file :
Tito_Scwrl_1JJK.pdb
: