Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKEKIVIALGGNAIQTKEATAEAQQTAIRRAMQNLKPLFDSPARIVISHGNGPQIGSLLIQQA-KSNSDTTPAMPLD-TCGAMSQGMIGYWLETEINRILTEMNSDRTVGTIVTRVEVDKDDPRFNNPTKPIGPFYTKEE---VE-----ELQKEQPDS---VFKEDAGRGYRKVVASPLPQSILE---HQLIRTLADGKNIVIACGGGGIP-VIKK-ENTYEGVEAVIDKDFASEKLATLIEADTLMILTNVENVFINFNEPNQQQIDDIDVATLKKYAAQGKFAEGSMLPKIEAAIRFVESGENKKVIITNLE-QAYEALIGN-KGTHIHM |
2WE5 Chain:A ((2-310)) | -GKKMVVALGGNAILSNDASAHAQQQALVQTSAYLVHLIKQGHRLIVSHGNGPQVGNLLLQQQAADSE-KNPAMPLDTCVAMT-QGSIGYWLSNALNQELNKAGIKKQVATVLTQVVVDPADEAFKNPTKPIGPFLTEAEAKEAMQAGAIFKEDAGRGWRKVVPS----------------PKPIDIHEAETINTLIKNDIITISCGGGGIPVVGQELKGVEAV----IDKDFASEKLAELVDADALVILTGVDYVCINYGKPDEKQLTNVTVAELEEYKQAGHFAPGSMLPKIEAAIQFVESQP-NKQAIITSLENLGSMSGDEIVGTVVTK |
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General information:
TITO was launched using:
| RESULT:
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Template: 2WE5.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -110277 for 2334 contacts (-47.2/contact) +
2D Compatibility (PS) -31784 + (NN) -18053 + (LL) 1236
1D Compatibility (HY) -20400 + (ID) 6400
Total energy: -185678.0 ( -79.55 by residue)
QMean score : 0.549
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