Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MSATGPFSIGERVQLTDAKGRRYTMSLTPGAEFHTHRGSIAHDAVIGLEQGSVVKSSNGALFLVLRPLLVDYVMSMPRGPQVIYPKDAAQIVHEGDIFPGARVLEAGAGSGALTLSLLRAVGPAGQVISYEQRADHAEHARRNVSGCYGQPPDNWRLVVSDLADSELPDGSVDRAVLDMLAPWEVLDAVSRLLVAGGVLMVYVATVTQLSRIVEALRAK-QCWTEPRAWETLQRGWNVVGLAVRPQHSMRGHTAFLVATRRLAPGAVAPAPLGRKREGRDG
3MB5 Chain:A ((1-254))
-----MIREGDKVVLVDPRGKRYLITVS-KRDFHTDLGILKLEEIIGRNFGEAIKSHKGHEFKILRPRIVDYLDKMKRGPQIVHPKDAALIVAYAGISPGDFIVEAGVGSGALTLFLANIVGPEGRVVSYEIREDFAKLAWENIKWAG--FDDRVTIKLKDIYEGI-EEENVDHVILDLPQPERVVEHAAKALKPGGFFVAYTPCSNQVMRLHEKLREFKDYFMKPRTINVLVFDQEVKKECMRPRTTALVHTGYITFARRIL------------------
General information:
TITO was launched using:
RESULT:
Template:
3MB5.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -151882 for 2025 contacts (-75.0/contact) +
2D Compatibility (PS) -27771 + (NN) -16051 + (LL) 272
1D Compatibility (HY) -13600 + (ID) 4500
Total energy: -213532.0 ( -105.45 by residue)
QMean score : 0.483
(partial model without unconserved sides chains):
PDB file :
Tito_3MB5.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3MB5-query.scw
PDB file :
Tito_Scwrl_3MB5.pdb
: