Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKKIAIDAMGGDYAPKAIVEGVNQAISDFSDIEVQLYGDQKKIEKYLTVTE-RV--SIIHTE-E-------KINSD-D-EPA--------KAVRRKKQSSMVLGAKAVKDGVAQAFISA-GNTGALLAAGLFVV------GRIKGVDRPGLMSTMPTLDGVGFDMLDLGANA-----ENTASHLHQYAILGSFYAKNVRGIEVPRVGLL--N--------NGTEETKGDSLHKEAYELLAAEPSINFIGNIEARDLMSS----VADVVVT-DGFTGNAVLKTMEGTAMSIMGSLKSSIKSGGVKAKLGALLLKDSLYQLKDSMDYSSAGGAVLFGLKAPIVKCHGSSDSKAVYSTLKQVRTMLETQVVDQLVDAFTDE |
3LXY Chain:A ((21-280)) | ------------VGPDLAITLAQQD--W--PVELVVCADPALLLARASQLNLPLQLREYQADQPAIAQQAGSLTILPVKTAVNVVPGKLDVGNSHYVVETLAKACDGAISGEFAALVTGPVQKSIINDAGIPFIGHTEFFADRSHCQRV--VMMLATEE-LRVALATTHLPLLAVPGAITQASLHEVITILDNDLKTKFGITQPQIYVCGLNPHAGEGGHMGHEE---IDTIIPALNTLRQ-QGINLIGPLPADTLFQPKYLQHADAVLAMYHDQGLPVLKYQGFGRAVNITLGLPFIRTSVDHGTALELAATGTADVGSFITALNLAIKMINNS------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3LXY.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -48878 for 1403 contacts (-34.8/contact) +
2D Compatibility (PS) -22595 + (NN) -4705 + (LL) 3324
1D Compatibility (HY) -5600 + (ID) 1800
Total energy: -80254.0 ( -57.20 by residue)
QMean score : 0.350
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