Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MLELKNKISAEAPKTDPSLAGVAANAILDVLGAVPSKPLRVQAELYKK-ESNNEEMDHTRDSGINNQSSGIKKSASEGTLFSESWDSKKTSGDWKRLLDNKPGDGSDTPPTPFTPKDDSYIENSETDSTTPLISSGKKTNRVWPRVKYAMQQKGVIIFGANTIILCTSLALVYLQDKAKFIVFFANSPFYITILVIASASLFAVSPIFHIIKQFRDAEEYQIQKGNANEILDKVLECQPRDKVIKSVRLEYSNDTHSNFALNAWEAKDNFINIGEKVISRANKIESIINNRPLFIALLTSVVAANIAFPLGLLAIDGINNVQKFYQNPLTHNVGLSLFIGSGILALSIICLGVHYYRKTNCTNLIYSQEKINTESVNKKFIKKIEQERTNVLKDNHGKDAKCISLTLEQVVVQSHNCKDIVYSIGE |
1T5J Chain:A ((3-303)) | LVKMRDKILGSV------FGAVIGDALGMPTENLTKEEIKKLYGFVDSYVEPKNYLAGKLNKGEWTDDTEQAICLIK-SLTKEGIDIKKFANCLIAWKNKNPPD------------------------------IGLTSLMAIDKLENN-DYSGVDSSSCGAAMRIYPLGIVFHNNLKKLKEEVIKASKITHNNKTAIAGALAIAFFVSSALK----------DRKDFSLLDECYNYIK--------------DIDEEFAKKLLEIKNF---------NNLDYIYDYFGTGVKTDEVVPSAIATYLL------------------TDNFKEGMLKCINAGGDTDSLASMYGAMAGAYY-------------GFKNIPKEWIDGLK-------------NKEVIFELAERLYHLATE---------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 1T5J.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -141191 for 2853 contacts (-49.5/contact) +
2D Compatibility (PS) -31744 + (NN) -7591 + (LL) 5912
1D Compatibility (HY) -6400 + (ID) 1850
Total energy: -182864.0 ( -64.10 by residue)
QMean score : 0.323
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