Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MLIAIEGVDGAGKRTLVEKLSGAFRAAGRSVATLAFPRYGQSVAADIAAEALHGEHGDLASSVYAMATLFALDRAGAVHTIQGLCRGYDVVILDRYVASNAAYSAARLHENAAGKAAAWVQRIEFARLGLPKPDWQVLLAVSAELAGERSRGRAQRDPGRARDNYERDAELQQRTGAVYAELAAQGWGGRWLVVGADVDPGRLAATLAPPDVPS
4UNN Chain:A ((1-209))
VLIAIEGVDGAGKRTLVEKLSGAFRAAGRSVATLAFPRYGQSVAADIAAEALHGEHGDLASSVYAMATLFALDRAGAVHTIQGLCRGYDVVILDRYVASNAAYSAARLHENAAGKAAAWVQRIEFARLGLPKPDWQVLLAVS-------------------------DAELQQRTGAVYAELAAQGWGGRWLVVGADVDPGRLAATLAP-----
General information:
TITO was launched using:
RESULT:
Template:
4UNN.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -130790 for 1511 contacts (-86.6/contact) +
2D Compatibility (PS) -21035 + (NN) -16285 + (LL) 868
1D Compatibility (HY) -23600 + (ID) 9150
Total energy: -199992.0 ( -132.36 by residue)
QMean score : 0.855
(partial model without unconserved sides chains):
PDB file :
Tito_4UNN.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4UNN-query.scw
PDB file :
Tito_Scwrl_4UNN.pdb
: