Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTKGIKIATIGGGS-SYTPELIEGFIKRQDELPVRE--LWLVDVEAGREKLEIVGNLAKRMVEKAGVDMEVHLTLDREEALKDADFVTTQLRVGLLDARVKD-------------ERIPNSYGVVGQETNGPGGMFKGLRTIP---VILDICKDMERLCPDAWLINFANPAGMVTEAVLRYSNQKKVVGLCNGPIGIERNIAETLGVDVSEIYVEFVGLNHMVFAKTVYHNGKDVTKDVVFKMTEDEAGSSLKNINATGWDKT-------FLRTLNMIPI-DYLRY-YWQTKQQLEDQARAYAEHG---------TRAEVVKKVEAELFELYKQEELAEKP--KQLEQR-----GGAYYSEAACNLINSIYNDKRDIQIVNTRNNGAILDIDPDSAVETNCVITRQGPIPLASGRLPIAINGIIQEIKTFERLTAEAAVTGDYDKALLAMTINPLTPSESVAREMLDELLEAHKEYLPNFFK |
3U95 Chain:A ((1-390)) | ----MKISIVGAGSVRFALQLVED-IAQTDELSREDTHIYLMDVHERRLNASYI--LARKYVEELNSPVKVVKTESLDEAIEGADFIINT--AYPYDPRYHDSGSQRWDEVTKVGEKHGYYRGIDSQELNMVSTYTYVLSSYPDVKLALEIAEKMKKMAPKAYLMQTANPVFEITQAVRRWTGA-NIIGFCHGVAGV-YEVFERLGLDPEEVDWQVAGVNHGIWLNRFRYRGKDAYPLLDEWIEKELSKWEPKN----PWDTQMSPAAMDMYRFYGMLPIGDTVRNGTWKYHYNLETKKKWFRRFGGIDNEVERPKFHEHLRRARERLIKL--AEEVQENPHLKITEKHPEIFPKGRLSGEQHIPFINAIANNKRVRLFLNVENQGALKDFPDDLVMELPVWVDSSG--------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3U95.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -147193 for 2633 contacts (-55.9/contact) +
2D Compatibility (PS) -37823 + (NN) -21548 + (LL) 6720
1D Compatibility (HY) -19600 + (ID) 5150
Total energy: -224594.0 ( -85.30 by residue)
QMean score : 0.390
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