Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MAGLSHPSVFGRATHAVVRAPPESLCRHALRRSQGEEVDFARAERQHQLYVGVLGSKLGLQVVQLPADESLPDCVFVEDVAVVCEETALITRPGAPSRRKEVDMMKEALEKLQLNIVEMKDENATLDGGDVLFTGREFFVGLSKRTNQRGAEILADTFKDYAVSTVPVADSLHLKSFCSMAGPNLIAIGSSESAQKALKIMQQMSDHRYDKLTVPDDMAANCIYLNIPSKGHVLLHRTPEEYPESAKVYEKLKDHLLIPVSNSEMEKVDGLLTCCSVFINKKTDS
3P8E Chain:A ((32-305))
--------AFGRATHAVVRALPESLGQHALRS--GEEVDVARAERQHQLYVGVLGSKLGLQVVELPADESLPDCVFVEDVAVVCEETALITRPGAPSRRKEVDMMKEALEKLQLNIVEMKDENATLDGGDVLFTGREFFVGLSKRTNQRGAEILADTFKDYAVSTVPVADGLHLKSFCSMAGPNLIAIGSSESAQKALKIMQQMSDHRYDKLTVPDDIAANCIYLNIPNKGHVLLHRTPEEYPESAKVYEKLKDHMLIPVSMSELEKVDGLLTCCSVLINKK---
General information:
TITO was launched using:
RESULT:
Template:
3P8E.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -187979 for 2401 contacts (-78.3/contact) +
2D Compatibility (PS) -30090 + (NN) -13784 + (LL) 244
1D Compatibility (HY) -36400 + (ID) 12900
Total energy: -280909.0 ( -117.00 by residue)
QMean score : 0.617
(partial model without unconserved sides chains):
PDB file :
Tito_3P8E.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3P8E-query.scw
PDB file :
Tito_Scwrl_3P8E.pdb
: