Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MIPLIGQLYRNNNVVTSIHGRGLINRSVIAIMKAHRFARHRMADDAELSVHETFPILKAMSELKLGAASVDLGKMVAKFKAEGNGRSIEDFVKAELAEVVGKQNGDAREGTDVVLYGFGRIGRLLARILIEKTGGGDGLRLRAIVVRKGAENDLVKRASLLRRDSVHGPFDGTITIDEENNTLTANGNLIQVIYSNDPASIDYTQYGIKNALLVDNTGKWRDAEGLGQHLKCPGIDRVVLTAPGKGALKNIVHGINHTDIGADDKIISAASCTTNAIVPVLKAVNDQYGIVNGHVETVHSYTNDQNLIDNFH-KGSRRGRSAPLNMVITETGAATAAAKALPVLKGKLTGNAIRVPTPNVSMAILNLNLEKATTREEINEYLRQMAMHSDLQKQIDFVSSQEVVSTDFVGSRHAGVVDAEATIC-NDNRVVLYVWYDNEFGYSCQVVRVMEDMAGVNPPAFPR |
3PYM Chain:A ((1-331)) | -------------------------------------------------------------------------------------------------------------MVRVAINGFGRIGRLVMRIALSR----PNVEVVALNDPF---ITNDYAAYMFKYDSTHGRYAGEVSH--DDKHIIVDGKKIATYQERDPANLPWGSSNVD--IAIDSTGVFKELDTAQKHIDA-GAKKVVITAPSST-APMFVMGVNEEKYTSDLKIVSNASCTTNCLAPLAKVINDAFGIEEGLMTTVHSLTATQKTVDGPSHKDWRGGRTASGNIIPSSTGAAKAVGKVLPELQGKLTGMAFRVPTVDVSVVDLTVKLNKETTYDEIKKVVKAAA-EGKLKGVLGYTE-DAVVSSDFLGDSHSSIFDASAGIQLSPKFVKLVSWYDNEYGYSTRVVDLVEHVAK-------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3PYM.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -225273 for 2901 contacts (-77.7/contact) +
2D Compatibility (PS) -36361 + (NN) -17797 + (LL) 8240
1D Compatibility (HY) -19200 + (ID) 6050
Total energy: -296441.0 ( -102.19 by residue)
QMean score : 0.557
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