Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MGHQNHTFSSDFILLGLFSSSPTSVVFFLVLFVIFIMSVTENTLMILLIRSDSRLHTPMYFLLSHLSLMDILHVSNIVPKMVTNFLSGSRTISFAGCGFQVFLSLTLLGGECLL--LAAMSCDRYVAICHPLRYPILMKEYASALMAGGSWLIGVFNSTVHTAYALQFPFCGSRAIDHFFCEVPAMLKLSCA-------DTTRYERGVCVSAVIFLLIPFSLISASYGQIILTV----LQMKSSEARKKSFSTCSFHMIVVTM--------YYGPFIFTYMRPKSYHTPGQDKFLAI--FYTILTPTLNPFIYSFRNKDVLAVMKNMLKSNFLHKKMNRKIPECVFCLFLC |
3CAP Chain:A ((44-312)) | ------------------------------MFLLIMLGFPINFLTLYVTVQHKKLRTPLNYILLNLAVADLFMVFGGFTTTLYTSLHGYFVFGPTGCNLEGFFA--TLGGEIALWSLVVLAIERYVVVCKPMSN-FRFGENHAIMGVAFTWVMAL--------------ACAAPPLVGWSRYIPEGMQCSCGIDYYTPHEETNNESFVIYMFVVHFIIPLIVIFFCYGQLVFTVKEAAAQQQESATTQKAEKEVTRMVIIMVIAFLICWLPYAGVAFYIFTHQGSDFGP---IFMTIPAFFAKTSAVYNPVIYIMMNKQFRNCMVTTLCCGKN------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3CAP.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -180387 for 1733 contacts (-104.1/contact) +
2D Compatibility (PS) -24976 + (NN) -3783 + (LL) 4772
1D Compatibility (HY) -24000 + (ID) 3050
Total energy: -231424.0 ( -133.54 by residue)
QMean score : 0.175
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