Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSEKKILILCQYFYP--EYVSSATLPTQLAEDLIANHINVDVMCGWPYEYSNHKQVS------K----------TEMHRGIRIRRLKYSRFNNKSKVG--RIINFFSLFS---KFVINI--------PKMLKYDQILVYSNPPILPLIPDVLHRLL-------KKKYSFVVYDIAPDNAIKTGA---TRPGS--------------MIDKLMRYINRHVYKNAENVIVLGTEMKNYLLNHQIS--K-----NADNIHVIPNWYDMRQLQDNRIYN---------------DTFKAYR-------EQYDKILLYSGNMGQLQDMETLISFLKLNKDQPQTLTILCGHGKKF--ADVKTAIEDHRI-ENVKMFEFLTGTDYADVLKIADVCIASLIKEGVGLGVPSKNYGYLAAKKPLVLIMDKQSDIVQHVEQYDAGI----------QIDNGDAHAIYNFINTH--SSKELHEMGERAHQLFKDKYTREINTMKYYNLLK |
3VUE Chain:A ((8-509)) | -HHMNVVFVGAEMAPWSKTGGLGDVLGGLPPAMAANGHRVMVISPRYDQYKDAWDTSVVAEIKVADRYERVRFFHCYKRGVDRVFIDHPSFLEK----KDNQMRFSLLCQAALEAPRILNLNNNPYFKGTYGEDVVFVCNDWHT-GPLASYLKNNYQPNGIYRNAKVAFCIHNISYQGRFAFEDYPELNLSERFRSSFDFIDGYDTPVEGRKINWMKAGILEADRVLTVSPYYAEELISGIARGCELDNIMRLTGITGIVNGMDVSEWDPSKDKYITAKYDATTAIEAKALNKEALQAEAGLPVDRKIPLIAFIGRLEEQKGPDVMAAAIPELMQ-EDVQIVLLGTGKKKFEKLLKSMEEK--YPGKVRAVVKFNAPLAHLIMAGADVLAVPSRFEPCGLI----QLQGMRYGTPCACAS--TGGLVDTVIEGKTGFHMGRLSVDCKVVEPSDVKKVAATLKRAIKVVGT-PAYEEMVRNCMNQDLSWKGPAKNWENVLL |
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General information:
TITO was launched using:
| RESULT:
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Template: 3VUE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -229234 for 3188 contacts (-71.9/contact) +
2D Compatibility (PS) -40405 + (NN) -7977 + (LL) 956
1D Compatibility (HY) -10000 + (ID) 2550
Total energy: -289210.0 ( -90.72 by residue)
QMean score : 0.380
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