Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLEKQHIQYFKNLVGGEDFFTDLAHLNAYCYDATK-ERHLPSGVIFPKNEREISQILKYCN-EHRLIVVPRGAGSGFTGGALSVSGGLVLSVEKHLD-KILEID-----TKNLIARVEPGVINKHFQNEV-EKLDLFYPPDPASENQSTLGGNVAENAGGMRAAKYGITKDYVMALRVVLANGEIIRAGKKTIKDVAGFNIAGLMIASEGCLGVISEITLKLLAKPPLKQSAMGVFNHIEDAMNAVYKTMSSGVTPVAMEFLDNLSIKAVEE---RFSK------------GLPK-DAGAILITQV----DGVV-KEQIAWQLNEIEKHFKANGCVGFKIAQNEQEEQDLWFSRRNASQSISV---YGKKKLNEDVTVPRASLPSLLQEVAKISQKYGFKIPCFGH------TG---------DGNVHVNIMLED-------PKRDLEKGHKAMEEIFQAAISLEGT--LSGEHGIGLSKAKFMPLAFNHSEMELFRNIKKALDPNNILNPFKMGL |
2EXR Chain:A ((34-520)) | ------------LNIQGEILCGGAAADIAGRDFGGMNCVKPLAVVRPVGPEDIAGAVKAALRSDKLTVAARGNGHSINGQAMA-EGGLVVD-MSTTAENHFEVGYLSGGDATAFVDVSGGALWEDVLKRCVSEYGLAPRSWTDY-LGLTVGGTLSNAGVSGQAFRYGPQTSNVTELDVVTGNGDVVTCSE-----IENSELFFSVLGGLGQFGIITRARVLLQPAPDMVRWIRVVYTEFDEFTQDAEWLVSQ-KNESSFDYVEGFVFVNGADPVNGWPTVPLHPDHEFDPTRLPQSCGSVLYCLELGLHYRDSDSNSTIDKRVERLIGRLRFNEGLRFE--VDLPYVDFLLRVKRSEEI-AKENGTWETPHPWLNLFVSKRDIGDFNRTVFKELVKNGVNGPMLVYPLLRSRWDDRTSVVIPEEGEIFYIVALLRFVPPCAKVSSVEKMV-AQNQEIVHWCVKNGIDYKLYLPHYKSQ--EEWIR-HFG-NRWSRFVDRKAMFDPMAILSPGQKIF |
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General information:
TITO was launched using:
| RESULT:
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Template: 2EXR.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -97932 for 3614 contacts (-27.1/contact) +
2D Compatibility (PS) -45761 + (NN) -9250 + (LL) 2492
1D Compatibility (HY) -13200 + (ID) 3450
Total energy: -167101.0 ( -46.24 by residue)
QMean score : 0.348
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