Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
QSCPNELN--RLNVCAPFVVP----GVP----EATP-----------SSDCCAALQSVQHDCLCNTLR----------------------IASRLPSRCNIPALSCGVQINA
1PSY Chain:A ((16-116))
QQCRQEVQRKDLSSCERYLRQSSSRRSTGEEVLRMPGDENQQQESQQLQQCCNQVKQVRDECQCEAIKYIAEDQIQQGQLHGEESERVAQRAGEIVSSCGV-----------
General information:
TITO was launched using:
RESULT:
Template:
1PSY.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -29494 for 366 contacts (-80.6/contact) +
2D Compatibility (PS) -6061 + (NN) -2705 + (LL) 616
1D Compatibility (HY) -4400 + (ID) 700
Total energy: -42744.0 ( -116.79 by residue)
QMean score : 0.460
(partial model without unconserved sides chains):
PDB file :
Tito_1PSY.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-1PSY-query.scw
PDB file :
Tito_Scwrl_1PSY.pdb
: