Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTLLEKINETRDFLQAKGVTAPEFGLILGSGLGELAEEIENPIVVDYADIPNWGQSTVVGHAGKLVYGDLSGRKVLALQGRFHFYEGNTMEIVTFPVRIMRALACHSVLVTNAAGGI--GYGPGTLMLIKDHIN---VIGTNPLIGENLEEFGPRFPDMSDAYTATYRQKAHQIAEKQNIKL--EEGVYLGVSGPTYETPAEIRAFQTMGAQAVGMSTVPEVIVAAHSGLKVLGISAITNFAAG---FQSELNHEEVVEVTQRIKEDFKGLVKSLVAEL |
3KHS Chain:B ((1-279)) | MTDYDLAKETAAWLNKQLQIRPVLGIVCGSGLGKIGDSLETSITVAYSDIPNFPVG-----AGSLIFGSVNGVSCVCMKGRFHLYEGHTAARATFPMRVFKALGVKIVVLTNAAGGLNPSYRPGDFMVVRDHINLPGLAGANPLTGPNDDTEGERFPSMTSVYDKTLRKYAISAARELGMSYATHEGVYCCVNGPSFETPAECKILRLMGSDAVGMSTAPETIVAKHGGMRCLAVSLISNVIASNCE--------EVLRAGEEASARMTALVKLVIEKI |
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General information:
TITO was launched using:
| RESULT:
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Template: 3KHS.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -151819 for 2154 contacts (-70.5/contact) +
2D Compatibility (PS) -27128 + (NN) -8378 + (LL) 880
1D Compatibility (HY) -24000 + (ID) 5350
Total energy: -215795.0 ( -100.18 by residue)
QMean score : 0.562
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