Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKNKKNNYDLMYFIPLVFLIYPIGGILYYHYPFWTLFFTLAFVGAYLYSVIIRGESKYHMIAWSTMLTYIFYMTIFINSGFIWYIYFLSNLLVYRFRDKLKSFRFISFACTLATVVFLCFFKASDFGDRIMFLIVPIFCIGYMWIAIENRNSEEQREKIAEQNQYINILSAENERNRIGRDLHDSLGHTFAMMTLKTELALKLLEKRNYDKVQKELSELNHISHQSMSEVRQIVSNLKYRTVVEEIDELYRLFQLSNIKLTVVNKLETSQLSPVTQSTITMILKELSNNIVKHAEADSVELSLVRQGATINIEMIDNGC--GFTN--LDGDEFHSIQERLTIVEGTLTILSRSKPTHIQVVLKEV |
3GIG Chain:A ((14-201)) | ----------------------------------------------------------------------------------------------------------------------------------------------------------------DANERIAELVKLEERQRIARDLHDTLGQKLSLIGLKSDLARKLIYK-DPEQAARELKSVQQTARTSLNEVRKIVSSMKGIRLKDELINIKQILEAADIMFIYEEEKWPENISLLNENILSMCLKEAVTNVVKHSQAKTCRVDIQQLWKEVVITVSDDGTFKGEENSFS--HGLLGMRERLEFANGSLHIDTENGTKLTMAIPNN- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3GIG.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -51828 for 1092 contacts (-47.5/contact) +
2D Compatibility (PS) -19609 + (NN) -3727 + (LL) 14936
1D Compatibility (HY) -11200 + (ID) 2700
Total energy: -74128.0 ( -67.88 by residue)
QMean score : 0.446
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