Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTALDWRSALTADEQRSVRALVTATTAVDGVAPVGEQVLRELGQQRTEHLLVAGSRPGGPIIGYLNLSPPRGAGGAMAELVVHPQSRRRGIGTAMARAALAKTAGRNQFWAHGTLDPARATASALGLVGVRELIQMRRPLRDIPEPTIPDGVVIRTY-AGTSDDAELLRVNNAAFAGHPEQGGWTAVQLAERRGEAWFDPDGLILAFGDSPRERPGRLLGFHWTKVHPDHPGLGEVYVLGVDPAAQRRGLGQMLTSIGIVSLARRL-GGRKTLDPAVEPAVLLYVESDNVAAVRTYQSLGFTTYSVDTAYALAGTDN |
4IUS Chain:A ((85-254)) | -----------------------------------------------------------------------------------------------------------------ANPGLAYVLVEHGMTIVSRPPLLAVEPGDLLVPEFPAGVTAAVVASAE-EQEAANAIAGDAYETD-------ASPFQPE----PA-DGGAVLIRM------DGVPVATAAWTAIA--DGVTEVAGVGTLHSHRRQGLGALATAYATQQAF-EVGG---------ATLAWLTP--GDDGADRIYRRLGYEPKATAVHLGDPG--- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4IUS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -88182 for 1288 contacts (-68.5/contact) +
2D Compatibility (PS) -17674 + (NN) -4977 + (LL) 7764
1D Compatibility (HY) 3200 + (ID) 1450
Total energy: -101319.0 ( -78.66 by residue)
QMean score : 0.383
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