Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRRSPKGSPGAVLDLQRRVDQAVSADHAELMTIAKDANTFFGAESVQDPYPLYERMRAAGSVHRIAN---SDFYAVCGWDAVNEAIGRPEDFSSNLTATMTYTAEGTAKPFEMDPLGGPTHVLATADDPAHAVHRKLVLRHLAAKRIRVMEQFTVQAADRLWVDGM---QDGCIEWMGAMANRLPMMVVAELIGLPDPDIAQLVKWGYAATQLLEGLVENDQLVAAGVALMELSGYIFEQFDRAAADPRDNLLGELA-TACASGELDTLTAQVMMV-TLFAAGGESTAALLGSAVWILATRPDIQQQVRANPELLGAFIEETLRYEPPFRG-HYRHVRNATTLDGTELPADSHLLLLWGAANRDPAQFEAPGEFRLDRAGGKGHISFGKGAHFCVGAALARLEARIVLRLLLDRTSVIEAADVGG----WLPSILVRRIERLELAVQ |
2C6H Chain:B ((40-423)) | ----------------------------------------LGQDFAADPYPTYARLRAEGPAHRVRTPEGDEVWLVVGYDRARAVLADPR-FSKDWRNSTTPLTEAEA---------ALNHNMLESDPPRHTRLRKLVAREFTMRRVELLRPRVQEIVDGL-VDAMLAAPDGRADLMESLAWPLPITVISELLGVPEPDRAAFRVW-------TDAFVFPDDPAQAQTAMAEMSGYLSRLIDSKRGQDGEDLLSALVRTSDEDGSRLTSEELLGMAHILLVAGHETTVNLIANGMYALLSHPDQLAALRADMTLLDGAVEEMLRYEGPVESATYRFPVEPVDLDGTVIPAGDTVLVVLADAHRTPERFPDPHRFDI-RRDTAGHLAFGHGIHFCIGAPLARLEARIAVRALLERCPDL-ALDVSPGELVWYPNPMIRGLKALPI--- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2C6H.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -249690 for 3001 contacts (-83.2/contact) +
2D Compatibility (PS) -40523 + (NN) -24845 + (LL) 3924
1D Compatibility (HY) -22800 + (ID) 6600
Total energy: -340534.0 ( -113.47 by residue)
QMean score : 0.461
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