Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MCELLGMSANVPTDIVFSFTGLMQRGGGTGPHRDGWGIAFYEGRG-VRLFQDPLASVDSEVARLVQRFPIKSETVIGHIRQ-ANVGKVGL-SNTHPFIRELGGRYWTFAHNGQLAD-FQPKPGFYRPVGETDSEAAFCDLLNRVRRAFPEPVPVEVLLPVLISACDEYRKKG-VFNALISDGDWLFTFCSSKLAYITRRAPFGPARLKDADLTVDFHAETTPDDVVTVIATEPLTDNENWTLQQSGE-WVLWWGGEVLAKGRV |
3MDN Chain:A ((2-257)) | ----CRWAAYHGTPIFLEDV-------------IGFGVAWYDARPEPGLYRDVYPAWSDPNLRAVAHH-VRSGLFLSHVCHPFAARRWCFMHN---------GQVGGFEAFRKQADMAIADEFYTYRKGSTDSEVLFLLALSEGLEHDPHGALARAIARLEGLSRAHGTTPHMRLSAAFSDG---------QTLYAARYSSDHIAP--------SVYYRYSHARQGWAVVSEPLDEG-DWTELRPGRMLTIGAEGAAERDFAP |
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General information:
TITO was launched using:
| RESULT:
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Template: 3MDN.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -26168 for 1666 contacts (-15.7/contact) +
2D Compatibility (PS) -21192 + (NN) -405 + (LL) 2032
1D Compatibility (HY) 7200 + (ID) 1050
Total energy: -39583.0 ( -23.76 by residue)
QMean score : 0.123
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