Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKYLDVD--GIGQVSRIGLGTWQFGSREWGYGDRYATGAARDIVKRARALGVTLFDTAEIYGLGKSERILGEALGD---DRTEVVVASKVFPVA-------PFPAVIKNRERASARRLQLNRIPLYQIHQPNPVVPDSVIMPGMRDLLDSGDIGAAGVSNYSLARWRKADAAL----GRPVVSNQVHFSLAHPDA-LEDLVPFAELENRIVIAYSPLAQGLLGGKYGLENRPGGVRAL---NP----LFGTENLRRIEPLLATLRAIAVDVDAKPAQVALAWLISLPGV-VAIPGASSVEQLEFNVAAADI--ELSAQSRDALTDAARAFRPVSTGRFLTDMVREKVSRR |
3LUT Chain:A ((37-360)) | QFYRNLGKSG-LRVSCLGLGTWVTFGG------QITDEMAEHLMTLAYDNGINLFDTAEVYAAGKAEVVLGNIIKKKGWRRSSLVITTKIFWGGKAETERGLSRKHIIEGLKASLERLQLEYVDVVFANRPDPNTPMEETVRAMTHVINQGMAMYWGTSRWSSMEIMEAYSVARQFNLIPPICEQAEYHMFQREKVEVQLPELFHKIGVGAMTWSPLACGIVSGKYDSGIPPYS-RASLKGYQWLKDKILSEEGRRQQAKLKELQAIAERLGCTLPQLAIAWCLRNEGVSSVLLGASNAEQLMENIGAIQVLPKLSSSIVHEIDSILGNKPY------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3LUT.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -130733 for 2532 contacts (-51.6/contact) +
2D Compatibility (PS) -32102 + (NN) -13842 + (LL) 1788
1D Compatibility (HY) -10400 + (ID) 4100
Total energy: -189389.0 ( -74.80 by residue)
QMean score : 0.544
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