Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MRVLLIEKNSVLGGEIEKGLNVKGFMADVTESLEDGEYLMDIRNYDLVMVSDKNALSFVSRIKEKHSSIVVLVSSDNPTSEEEVHAFEQGADDYIAKPYRSIKALVARIEARLRFWGSNVIEIGDLTISPDEEKIIYKGREVEVKGKPFEVLTHLARHRDQIVSKEQLLDAIWEEPEMVTPNVIEVAINQIRQKMDKPLGISTVETVRRRGYRFCYPKPACEE
2HQO Chain:A ((1-119))
MRVLLIEKNSVLGGEIEKGLNVKGFMADVTESLEDGEYLMDIRNYDLVMVSDKNALSFVSRIKEKHSSIVVLVSSDNPTSEEEVHAFEQGADDYIAKPYRSIKALVARIEARLRFWGSN--------------------------------------------------------------------------------------------------------
General information:
TITO was launched using:
RESULT:
Template:
2HQO.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -58144 for 926 contacts (-62.8/contact) +
2D Compatibility (PS) -13618 + (NN) -10549 + (LL) 8152
1D Compatibility (HY) -17600 + (ID) 5950
Total energy: -97709.0 ( -105.52 by residue)
QMean score : 0.469
(partial model without unconserved sides chains):
PDB file :
Tito_2HQO.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-2HQO-query.scw
PDB file :
Tito_Scwrl_2HQO.pdb
: