Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MEHNGHDKLNGVLRGFLGDSFTLDGKEGGLNMSKMLEFIKKEKPK----MNVLLMGATGVGKSSLINALFGKEITKTGVGKPITQHLEKYIDEEKGL-----ILWDTKGIEDKDY--HDTMQSIKKEMEDSFKTLDEKEAIDVAYLCVKETSSRVQERERELL-----SFAKHWNIPTIVVFTHTQAEAGDAFVQETKGIIDEEWGFKGFVRAYVRVNSVAFSFRGLKVPVEGLEELVDETKKCLSDAEKNKKRHFLSIQRVKIQERKQAMIEECKTIIHVASGAAGVAGLIPIPFSDALAIAPIQAGMIYKMNDAFGMDLDKSVGASLVAGLLGVTAVAQVGRTLVNGFLKFIPVVGSVAGGATAAVITEGIGFAYLKVLEKCFNDETGEVNLPGEVGMITSLFKENYLNLDTIKKLKP |
3BB4 Chain:A ((21-173)) | ---------------------------------KLIEFFGKLKQKDMNSMTVLVLGKGGVGKSSTVNSLIGEQVVRVS---PF----LRPVMVSRTMGGFTINIIDTPGLVEAGYVNHQALELIKGFLVN--------RTIDVLLYVDRLDVYRVDELDKQVVIAITQTFGKEIWCKTLLVLTHAQFSPPDELSYETFSSKRSDELLKTIRAGSKMRKQEFEDSAIAVVYAENSGRCSKNDKDEKALPNGEAWIPNLVKAITDVATNQRKAIHV-------------------------------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3BB4.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -35800 for 807 contacts (-44.4/contact) +
2D Compatibility (PS) -13942 + (NN) -364 + (LL) 12836
1D Compatibility (HY) -14000 + (ID) 2150
Total energy: -53420.0 ( -66.20 by residue)
QMean score : 0.551
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