Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
------------AGGCNAGQLSVCAVAITSGSPP-----SAECCSNLRAQQGCLCQYAKDPNYGRYI-----SSPYARQTVASCGIPVPKC------------------------------------------------------
1KNG Chain:A ((50-193))
RPAPQTALPPLEGLQADNVQVPGLDPAAFKG-KVSLVNVWASWCVPCHDEAPLLTELGKDKRFQLVGINYKDAADNARRFLGRYGNPFGRVGVDANGRASIEWGVYGVPETFVVGREGTIVYKLVGPITPDNLRSVLLPQMEKAL
General information:
TITO was launched using:
RESULT:
Template:
1KNG.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -17955 for 381 contacts (-47.1/contact) +
2D Compatibility (PS) -7284 + (NN) -595 + (LL) -28
1D Compatibility (HY) -2400 + (ID) 600
Total energy: -28862.0 ( -75.75 by residue)
QMean score : 0.272
(partial model without unconserved sides chains):
PDB file :
Tito_1KNG.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1KNG-query.scw
PDB file :
Tito_Scwrl_1KNG.pdb
: