Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTETRTEKKKKTTSTFTKVMKIASVALLGIIFFSITGLAAKYYITVQNTFSKINVPLESSNKTLSDLEKKKPFSVLLMGSDARAGEKN-GRADTIILATANKQQNAVEMVSIPRDTKV---DYGNGDIGKINASYSNGGPSGTVSAVEKL--MPGVPVDYFISINMEGFKDLVDAVGGITVYNDIDLTEVNSKF--VKGNITLNGTEALQYVRIRHEDPRGDFGRQDRQRDVIIGIANKVISSSGVSNFESIMKAVGDNFQTNMTLTDITSM-------AANYSSVLKNVDSQELKGEGEMIYSESYGFDLYYFAPDKTDLERIITMFKKSLDITE |
2XXQ Chain:A ((126-349)) | --------------------------------------------------------------------KNQSFNIYVSGIDTYGPISSVSRSDVNILMTVNRDTKKILLTTTPADAYVPIADGGNNQKDKL----THAGIYGVDSSIHTLENLYGVDINYYVRLNFTSFLKMIDLLGGVDVHNDQEFSALHGKFHFPVGNVHLDSEQALGFVRERYSLADGDRDRGRNQQKVIVAILQKLTSTEALKNYSTIINSLQDSIQTNVPLETMINLVNAQLESGGNYK-----VNSQDLKGTGRM----------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2XXQ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -47481 for 1542 contacts (-30.8/contact) +
2D Compatibility (PS) -22066 + (NN) -1493 + (LL) 8512
1D Compatibility (HY) -16000 + (ID) 3400
Total energy: -81928.0 ( -53.13 by residue)
QMean score : 0.454
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