Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKILLIGASGTLGSAVKDRLEK-KAEVITAGRHSG------------------DVTVDITSIDSIKKMYE----QVGKVDAIVSATGSATFSPLTELTPEKNAVTISSKLGGQINLVLLGIDSLND--KGSFTLTTGIMMEDPIVQGASAAMANGAVTAFAKSAAIE-MPRGIRINTVSPNVLEESWDKLE---------------------SFFQGFVPVPAAKVARAFEKSVFGA---QTGESYKVY |
3AI3 Chain:A ((8-256)) | KVAVITGSSSGIGLAIAEGFAKEGAHIVLVARQVDRLHEAARSLKEKFGVRVLEVAVDVATPEGVDAVVESVRSSFGGADILVNNAGTGSNETIMEAADEKWQFYWELLVMAAVRLARGLVPGMRARGGGAIIHNASICAVQPLWYEPIYNVTKAALMMFSKTLATEVIKDNIRVNCINPGLILTPDWIKTAKELTKDNGGDWKGYLQSVADEHAPIKRFASPEELANFFVFLCSERATYSVGSAYFVD |
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General information:
TITO was launched using:
| RESULT:
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Template: 3AI3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -73692 for 1633 contacts (-45.1/contact) +
2D Compatibility (PS) -20856 + (NN) -2860 + (LL) 0
1D Compatibility (HY) -8400 + (ID) 1800
Total energy: -107608.0 ( -65.90 by residue)
QMean score : 0.483
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