Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MQQHSSKTAYVYSDKLLQYRFHDQHPFNQMRLKLTTELLLNANLLSPEQIVQPRIATGDELMLIHKYDYVEAIKHASH-GIISEDEAKKYGLNDEENGQFKHMHRHSATIVGGALTLADLIMSGKVLNGCHLGGGLHHAQPGRASGFCIYNDIAITAQYIAKEYNQRVLIIDTDAHHGDGTQWSFYADNHVTTYSIHETGKFLFPGSGHYTERGEDIGYGHTVNVPLEPYTEDASFLECFKLTVEPVVKSFKPDIILSVNGVDIHYRDPLTHLNCTLHSLYEIPYFVKYLADSYTNGKVIMFGGGGYNIWRVVPRAWSHVFLSLIDQPIQSGYLPLEWINKW-KHYSSELLPKRWEDRLNDYTYVPRTKEISEKNKKLALHIASWYESTRQ |
4QA1 Chain:A ((55-356)) | ------------------------------------------------RIVKPKVASMEEMATFHTDAYLQHLQKVSQE---------EYGLGYDCPAT-EGIFDYAAAIGGATITAAQCLIDGMCKVAINWSGGWHHAKKDEASGFCYLNDAVLGILRLRRKF-ERILYVDLDLHHGDGVEDTFSFTSKVMTVSLHKFSPGFFPGTGDVSDVGLGKGRYYSVNVPIQDGIQDEKYYQICESVLKEVYQAFNPKAVVLQLGADTIAGDPMCSFNMTPVGIGKC---LKYILQWQL--ATLILGGGGYNLANTA-RCWTYLTGVILGKTLSSEIPDHEFFTAYGPDYVLEITPSCRPDR--------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4QA1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -172992 for 2556 contacts (-67.7/contact) +
2D Compatibility (PS) -31127 + (NN) -11350 + (LL) 6492
1D Compatibility (HY) -16800 + (ID) 4000
Total energy: -229777.0 ( -89.90 by residue)
QMean score : 0.486
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