Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTISVFDLFTIGIGPSSSHTVGPMRAANQFVVALRRRGHLDDLEAMRVDLFGSLAATGAGHGTMSAILLGLEGCQPETITTEHKERRLAEIAASGVTRIGGVIPVPLTERDIDLHPDIVLPTHPNGMTFTAAGPHGRVLATETYFSVGGGFIVTEQTSGNSGQHPCSVALPYVSAQELLDICDRLDVSISEAALRNETCCRTENEVRAALLHLRDVMVECEQRSIAREGLLPGGLRVRRRAKVWYDRLNAEDPTRKPEFAEDWVNLVALAVNEENASGGRVVTAPTNGAAGIVPAVLHYAIHYTSAGAGDPDDVTVRFLLTAGAIGSLFKERASISGAEVGCQGEVGSAAAMAAAGLAEILGGTPRQVENAAEIAMEHSLGLTCDPIAGLVQIPCIERNAISAGKAINAARMALRGDGIHRVTLDQVIDTMRATGADMHTKYKETSAGGLAINVAVNIVEC |
1IIR Chain:A ((1-401)) | MRVLLA----------TCGSRGDTEPLVALAVRVRDLGA-----DVRMCAPPDCAERLAEVG-VPHVPVGPRAKPLTAEDVRRFTTEAIATQFDEIPAAAEGCAAVVTTGLLAAAIGVRSVAEKLGIPYFYAFHCPSYVPSPYY---------------PPPPIDIPAQWERNNQSAYQRYGGLLNSHRDAIGLPPVEDIFTFGYTDHPWVAADPVLAP--LQPTDLDAVQTGAWILPDERPL---------SPELAAFLDAGPPPVYLGFGAPADAVRVAIDAIRAHGRRVILSRGWADLVLPD----DGADCFAIGEVNHQVLFGRVA--------AVIHHGGAGTTHVAARAGAPQILLPQMADQPYYAGRVAELGVGVA------------HDGPIPTFDSLSAALATALT-------------PETHARATAVAGTIRTDGAAVAARLLLDAVSRE |
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General information:
TITO was launched using:
| RESULT:
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Template: 1IIR.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -136889 for 3291 contacts (-41.6/contact) +
2D Compatibility (PS) -39980 + (NN) 1588 + (LL) 3496
1D Compatibility (HY) -400 + (ID) 2100
Total energy: -174285.0 ( -52.96 by residue)
QMean score : 0.268
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