Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MYNNLRDFIEALEKKRDLIRIKKEVSTILEMTEIHRRVSLNKGPAIIFENVVTENGKSVIPVLVNLFGTIERIAFGLNISPGELRDLGKLLAFLQSPEPPKNLKDVIKMFPLLKVVLSMRSKIVNKAPCQEVVLTGDDVDLSLLPIQTCWPNEPAPLI-TWPIVITKGPTEDKQDNFNLGIYRMQVMDKKTTLMRWLAHRGGASHHKRWKENGRSIKFPAAAVIGSDPATLIAAVTPVPETLSEYQFAGLLRKKPLELVNCKTISLQVPAHAEIVLEGYVSLDSYRNEGPYGDHTGYYNSVEQ-FPEFNITAITMRKNPIYLSTFTGKPPDE-PSILGEALNEIFVPILINQ-FPEIVDFYLPPEGCSYRIA------------VVSVKKSYPGHAKRIIMGIFSFLKQFLYTKFIIVVDDDINIRDWKEVMWAISTRMDPVRDTV---MIENAP-IDYLDFASPESGLGGKMGFDATNKMPPETKREWGKKIEMS------EEIVKKVTEKWDEYGLTDD |
4IWS Chain:A ((29-515)) | ---DFRHFVDHLRRQGDLVDVHTEVDANLEIGAITRRVYERRAPAPLFHNI-----RDSLP-------GARVLGAPAGLRADRARAHSRLALHFGLPE-HSGPRDIVAMLRAAMRAEPIAPRRLERGPVQENVWLGEQVDLTRFPVPLLHEQDGGRYFGTYGFHVVQTP-DGSWDSWSVG--RLMLVDRNTLAGPTIPTQHIGIIREQWRRLGKPT--PWAMALGAPPAALAAAGMPLPEGVSEAGYVGALVGEPVEVVRTQTNGLWVPANTEIVLEGEISLDETALEGPMGEYHGYSFPIGKPQPLFHVHALSFRDQPILPICVAGTPPEENHTIWGTMISAQLLDVAQNAGLP--VDMVW----CSYEAATCWAVLSIDVQRLAALGTDAAAFAARVAETVFGSHAGHLVPK-LILVGNDIDVTEIDQVVWALATRAHPLHDHFAFPQIRDFPMVPYLDAEDKARGSGGRL---VINCLYPEQFAGQMRAATASFRHAYPTALRRRVEERWSDYGF--- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4IWS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -201017 for 3872 contacts (-51.9/contact) +
2D Compatibility (PS) -49335 + (NN) -27824 + (LL) 1212
1D Compatibility (HY) -23600 + (ID) 6650
Total energy: -307214.0 ( -79.34 by residue)
QMean score : 0.431
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