Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MNLLIMGLPGAGKGTQAAKIVEEFGVAHISTGDMFRAAMANQTEMGRLAKSYIDKGELVPDEVTNGIVKERLAEDDIAEKGFLLDGYPRTIEQAHALDATLEELGLRLDGVINIKVDPSCLIERLSGRIINRKTGETFHKVFNPPVDYKEEDYYQREDDKPETVKRRLDVNIAQGEPILEHYRKLGLVTDIEGNQEITEVFADVEKALLELK
4JKY Chain:B ((1-198))
MILVFLGPPGAGKGTQAKRLAKEKGFVHISTGDILREAVQKGTPLGKKAKEYMERGELVPDDLIIALIEEVFPKHG----NVIFDGFPRTVKQAEALDEMLEKKGLKVDHVLLFEVPDEVVIERLSGRRINPETGEVYHVKYNPPPPGVK--VIQREDDKPEVIKKRLEVYREQTAPLIEYYKKKGILRIIDASKPVEEVYRQVLEVIG---
General information:
TITO was launched using:
RESULT:
Template:
4JKY.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -67478 for 1504 contacts (-44.9/contact) +
2D Compatibility (PS) -21215 + (NN) -8713 + (LL) 856
1D Compatibility (HY) -17600 + (ID) 4450
Total energy: -118600.0 ( -78.86 by residue)
QMean score : 0.490
(partial model without unconserved sides chains):
PDB file :
Tito_4JKY.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4JKY-query.scw
PDB file :
Tito_Scwrl_4JKY.pdb
: