Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRQYMKMVRPFDFVIIILLILGSFLPLILFSVAEAKHVGDDVVAIISQDG--KVIREIPLTG--HKGNEQFTIKGKGAQYNLMEVDGERIRIKEDNSPDQVGVKMGWKSKAGDTIVCLPHKVFVEIKSTNKKSKDPDTDLIVPN----
3GGQ Chain:A ((6-149))
-SRPFSVLRAND-VLWLSLTAAEYDQSTYGSSTGPVYVSDSVTLVNVATGAQAVARSLDWTKVTLDGRPLSTIQQHSKTFFVLPLRG-KLSFWEAGTTKA-GYPYNYNTTASDQLLVENAAGHRVAISTYTTSLGAGPVSISAVAVLA
General information:
TITO was launched using:
RESULT:
Template:
3GGQ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -28196 for 974 contacts (-28.9/contact) +
2D Compatibility (PS) -14889 + (NN) -5483 + (LL) 636
1D Compatibility (HY) -3600 + (ID) 1200
Total energy: -52732.0 ( -54.14 by residue)
QMean score : 0.349
(partial model without unconserved sides chains):
PDB file :
Tito_3GGQ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3GGQ-query.scw
PDB file :
Tito_Scwrl_3GGQ.pdb
: