Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKKFFFIGLLVFVVFFTAATIIWFSYDKNKYGTKQYDKTFKDDAFDNVSINLD-STELRIKRGNQFRVKYDGDNDIL----INIVDKTLKISDKRSKTRGYAIDMNPFHENKK-TLTIEMPDKMIKRLNLSSGAGSVRISDVDLENTSIQSINGEVVIKNSNLDALDSKTNNSSTYIS-KSNIKNSNIKVVIGTLQIDKSQIKQSIFLNDHGDIEFKNMPSKVDAKASTKQGDIRFKYDSKPEDTILKLNPGTGDSVVKNKTFTNGKVGKSDNVLEFYTIDGNIKVE |
3PET Chain:A ((4-221)) | ---------------------------GIQPSKKLITRDYKVKEFNKIDAGTVGNIYYTQSTDGKTDLQIYGPDNIVALIQVAVKDNTLFLSIDKSK---------KVRNFKKMKITITSPT--LNGISFK-GVGDVHIEN------GLTTDNLDIESKGVGNVDIQSLTCQKLNVQSMGV-----------GDVKLEGTAQIAALHSKGVGNIEAGNLRANAVEASSQGVGDITCNATESIDAAV----RGVGSIKYK---------GSPTIKSLSKKGVGTIKNI |
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General information:
TITO was launched using:
| RESULT:
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Template: 3PET.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 55160 for 1745 contacts (31.6/contact) +
2D Compatibility (PS) -22298 + (NN) -5588 + (LL) 5664
1D Compatibility (HY) -4000 + (ID) 2050
Total energy: 26888.0 ( 15.41 by residue)
QMean score : 0.256
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