Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MATVEPETTPTPNPPTTEEEKTESNQEVANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYNHIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLDRFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENREAVTHIGRVYKERLGLPPKIVIGYQSHADTATKSGSTTKNRFVV
4AZA Chain:A ((27-217))
--------------------------EVANPEHYIKHPLQNRWALWFFKNDKSKTWQANLRLISKFDTVEDFWALYNHIQLSSNLMPGCDYSLFKDGIEPMWEDEKNKRGGRWLITLNKQQRRSDLDRFWLETLLCLIGESFDDYSDDVCGAVVNVRAKGDKIAIWTTECENREAVTHIGRVYKERLGLPPKIVIGYQSHADTATKSG---KNRFVV
General information:
TITO was launched using:
RESULT:
Template:
4AZA.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -83686 for 1395 contacts (-60.0/contact) +
2D Compatibility (PS) -19937 + (NN) -9253 + (LL) 904
1D Compatibility (HY) -26800 + (ID) 9400
Total energy: -148172.0 ( -106.22 by residue)
QMean score : 0.746
(partial model without unconserved sides chains):
PDB file :
Tito_4AZA.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4AZA-query.scw
PDB file :
Tito_Scwrl_4AZA.pdb
: