Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRPVFILGIILLLVGCKQRDERVLMVDEQGSFAVGG-----TVLVDSLGHTFHG----DHAYVFYQKPVGARKYPLVFAHGVGQFSKTWETTPDGREGFQNIFLRRRFCVYLVDQPRRGNAGRGTESVTI-----SPAFD--------EEVWFNRFRVGI-WPDYFEGVQFKRDKETLDQYFRQMTP----TIGTTDFEVYSDAYAALFDKIGPGVFITHSQGGPVGWNT-LLKTRNIKAIASYEPGGAVPFPEGQLPEEAKFITLSKKMEGIEVPMSVFMEYTKVPIVIYYGDNLPETDERPELYEWTRRLRLMKIWAKMLNDQGGDVTVIHLPEVGLHGNTHFPMSDLNNIEVADLLSEWLHTKALD |
2WKW Chain:A ((13-317)) | -----------------------LTLSGQGSFFVGGRDVTSETLSLSPKYDAHGTVTVDQMYVRYQIPQRAKRYPITLIHGCCLTGMTWETTPDGRMGWDEYFLRKGYSTYVIDQSGRGRSATDISAINAVKLGKAPASSLPDLFAAGHEAAWAIFRFGPRYPDAFKDTQFPVQAQA--ELWQQMVPDWLGSMPTPNPTVANLSKLAI--KLDGTVLLSHSQSGIYPFQTAAMNPKGITAIVSVEPG------ECPKPEDVKPL-------------------TSIPVLVVFGDHI------EEFPRWAPRLKACHAFIDALNAAGGKGQLMSLPALGVHGNSHMMMQDRNNLQVADLILDWI------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 2WKW.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -85080 for 2285 contacts (-37.2/contact) +
2D Compatibility (PS) -29915 + (NN) -15017 + (LL) 4772
1D Compatibility (HY) -16400 + (ID) 5200
Total energy: -146840.0 ( -64.26 by residue)
QMean score : 0.347
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