Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKNKKNNYDLMYFIPLVFLIYPIGGILYYHYPFWTLFFTLAFVGAYLYSVIIRGESKYHMIAWSTMLTYIFYMTIFINSGFIWYIYFLSNLLVYRFRDKLKSFRFISFACTLATVVFLCFFKASDFGDRIMFLIVPIFCIGYMWIAIENRNSEEQREKIAEQNQYINILSAENERNRIGRDLHDSLGHTFAMMTLKTELALKLLEKRNYDKVQKELSELNHISHQSMSEVRQIVSNLKY-----------RTVVEEIDEL----YRLFQLSNIKLTVVNKLETSQLSPVTQSTITMILKELSNNIVKHAEAD----SVELSLVRQGATINIEMIDNGCGFTN--------------LDGDEFHSIQERLTIVEGTLTILSRSK-PTHIQVVLKEV |
2C2A Chain:A ((18-247)) | ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------RMKTEFIANISHELRTPLTAIKAYAETIYNSLGELDLSTLKEFLEVIIDQSNHLENLLNELLDFSRLERKSLQINREKVDLCDLVESAVNAIKEFASSHNVNVLFESNVPCPVEAYIDPTRIRQVLLNLLNNGVKYSKKDAPDKYVKVILDEKDGGVLIIVEDNGIGIPDHAKDRIFEQFYRVD-TGLGLAITKEIVELHGGRIWVESEVGKGSRFFVWIPKD |
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General information:
TITO was launched using:
| RESULT:
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Template: 2C2A.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -55465 for 1249 contacts (-44.4/contact) +
2D Compatibility (PS) -20530 + (NN) -9640 + (LL) 16164
1D Compatibility (HY) -10400 + (ID) 1300
Total energy: -81171.0 ( -64.99 by residue)
QMean score : 0.458
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