Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MREYQRLKGFTDN---LELRRRNRATVEHYMRMKGAERLQRHSLFVEDGCAGNWTTESGEPLVFRGHESLRRLAEWLERCFPDWEWHNVRIFETEDPNHFWVECDGRGKALVPGYPQGYCENHYIHSFELENGRIKRNREFMNPMQKLRALGIAVPQIKRDGIPT
3JUQ Chain:A ((29-184))
--------NTSENRAQVAARQHNRKIVEQYMHTRGEARLKRHLLFTEDGVGGLWTTDSGQPIAIRGREKLGEHAVWSLQCFPDWVWTDIQIFETQDPNWFWVECRGEGAIVFPGYPRGQYRNHFLHSFRFENGLIKEQREFMNPCEQFRSLGIEVPEVRRDGLP-
General information:
TITO was launched using:
RESULT:
Template:
3JUQ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -34394 for 1002 contacts (-34.3/contact) +
2D Compatibility (PS) -16533 + (NN) -7223 + (LL) 1016
1D Compatibility (HY) -13600 + (ID) 4100
Total energy: -74834.0 ( -74.68 by residue)
QMean score : 0.576
(partial model without unconserved sides chains):
PDB file :
Tito_3JUQ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3JUQ-query.scw
PDB file :
Tito_Scwrl_3JUQ.pdb
: