Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTDLITVKKLGSRIGAQIDGVRLGGDLDPAAVNEIRAALLAHKVVFFRGQHQ-LDDAEQLAFAGLLGTPIGHPAAIALADDAPIITPINSEFGKANRWHTDVTFAANYPAASVLRAVSLPSYGGSTLWANTAAAYAELPEPLKCLTENLWALHTNRYDYVTTKPLTAAQRAFRQVFEKPDFRTEHPVVRVHPETGERTLLAGDFVRSFVGLDSHESRVLFEVLQRRITMPENTIRWNWAPGDVAIWDNRATQHRAIDDYDDQHRLMHRVTLMGDVPVDVYGQASRVISGAPMEIAG
4CVY Chain:A ((5-293))
----ITVKKLGSRIGAQIDGVRLGGDLDPAAVNEIRAALLAHKVVFFRGQ-HQLDDAEQLAFAGLLGTPI-------------------------NRWHTDVTFAANYPAASVLRAVSLPSYGGSTLWANTAAAYAELPEPLKCLTENLWALHTN------------------------DFRTEHPVVRVHPETGERTLLAGDFVRSFVGLDSHESRVLFEVLQRRITMPENTIRWNWAPGDVAIWDNRATQHRAIDDYDDQHRLMHRVTLMGDVPVDVYGQASRVISGAPMEI--
General information:
TITO was launched using:
RESULT:
Template:
4CVY.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -117645 for 1956 contacts (-60.1/contact) +
2D Compatibility (PS) -26044 + (NN) -13918 + (LL) 3616
1D Compatibility (HY) -32000 + (ID) 11900
Total energy: -197891.0 ( -101.17 by residue)
QMean score : 0.556
(partial model without unconserved sides chains):
PDB file :
Tito_4CVY.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-4CVY-query.scw
PDB file :
Tito_Scwrl_4CVY.pdb
: