Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKKGILNVLLVFALIAGLSVPSSMQVEAAAPTIKVHFIDVG---QGDAIYIKAPSGEDILIDAGNKGKGKTVVNYLKK--LKVKDIEIMIASHSDADNIGGLPEVMNNIKVKNLYAPKSTNTTA--AYKNFVNT----------AKKKKLTIKTAKAGVKLPVKGVNAQFVGPVKTYGKTDRNNWSAVLHVAYKKNTFLFTGDAQTKAENDMIKAKKTLRADVLKVSTQGSKAATSKAFVNVVKPKYAIISVGKNGYGHPTSQTVNTLKKAKAKVYRTDRNKTVVVTGNGSSYSIGK |
3IEK Chain:A ((1-167)) | --------------------------------MRIVPFGAAREVTGSAHLLLA-GGRRVLLDCGMFQGKEEA-RNHAPFGFDPKEVDAVLLTHAHLDHVGRLPKLFREGYRGPVYATRATVLLMEIVLEDALKVMDEPFFGPEDVEEALGHLRPLEYGEWLRLGALSLAFGQAGHLP-------GSAFVVAQGEGRTLVYSGDLGNRE----------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IEK.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -40829 for 1207 contacts (-33.8/contact) +
2D Compatibility (PS) -15927 + (NN) -1826 + (LL) 7816
1D Compatibility (HY) -4400 + (ID) 1200
Total energy: -56366.0 ( -46.70 by residue)
QMean score : 0.349
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