Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MALLEVKNLSKHFGGLTAVGDVSMKLHKGELIGLIGPNGAGKTTLFNLLTGVYLPSKGTISLDGKILNGRKPAKIASLGLGRTFQNIRLFKNMTVLDNVLVGLSNHHLSHPIASFLRLPKYYHSEKALRKKALELLEIFGLKAYQDALAKNLPYGKQRRLEIVRALATEPKILFLDEPAAGMNPQETAELTQLISQIKSDFDITIMLIEHDMNLVMQVTERIYVLEYGRLIAHGT-PEEIKN---NKRVIEAYLGGEL
1GAJ Chain:A ((5-256))
MEILRTENIVKYFGEFKALDGVSISVNKGDVTLIIGPNGSGKSTLINVITGFLKADEGRVYFENKDITNKEPAELYHYGIVRTFQTPQPLKEMTVLENLLIGEINPGES-PLNS-LFYKKWIPKEEEMVEKAFKILEFLKLSHLYDRKAGELSGGQMKLVEIGRALMTNPKMIVMDQPIAGVAPGLAHDIFNHVLELKAK-GITFLIIEHRLDIVLNYIDHLYVMFNGQIIAEGRGEEEIKNVLSDPKVVEIYIGE--
General information:
TITO was launched using:
RESULT:
Template:
1GAJ.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -143821 for 2035 contacts (-70.7/contact) +
2D Compatibility (PS) -26554 + (NN) -7283 + (LL) 240
1D Compatibility (HY) -26400 + (ID) 4550
Total energy: -208368.0 ( -102.39 by residue)
QMean score : 0.618
(partial model without unconserved sides chains):
PDB file :
Tito_1GAJ.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1GAJ-query.scw
PDB file :
Tito_Scwrl_1GAJ.pdb
: