Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
Query sequence
MTLSILVAHDLQRVIGFENQLPWHLPNDLKHVKKLSTGHTLVMGRKTFESIGKPLPNRRNVVLTSDTSFNVVGVDVIHSIEDIYQLPGHVFIFGGQILFEEMIDKVDDMYITVIEGKFRGDTFFPPYTFEDWEVASSVEGKLDEKNTIPHTFLHLIRKK
3SH2 Chain:B ((1-157))
-TLSILVAHDLQRVIGFENQLPWHLPNDLKHVKKLSTGHTLVMGRKTFESIGKPLPNRRNVVLTSDTSFNVEGVDVIHSIEDIYQLPGHVFIFGGQTLFEEMIDKVDDMYITVIEGKFRGDTFFPPYTFEDWEVASSVEGKLDEKNTIPHTFLHLIRK-
General information:
TITO was launched using:
RESULT:
Template:
3SH2.pdb
Alignment :
align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -123628 for 1157 contacts (-106.9/contact) +
2D Compatibility (PS) -16722 + (NN) -5428 + (LL) 272
1D Compatibility (HY) -23200 + (ID) 7750
Total energy: -176456.0 ( -152.51 by residue)
QMean score : 0.589
(partial model without unconserved sides chains):
PDB file :
Tito_3SH2.pdb
:
(Unconserved sides chains are recalculated) :
Sequence:
align-3SH2-query.scw
PDB file :
Tito_Scwrl_3SH2.pdb
: