Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSRESDVEAQQSHGSSACSQPHGSVTQSQGSSSQSQGISSSSTSTMPNSSQSSHSSSGTLSSLETVSTQELYSIPEDQEPEDQEPEEPTPAPWARLWALQDGFANLECVNDNYWFGRDKSCEYCFDEPLLKRTDKYRTYSKKHFRIFREVGPKNSYIAYIEDHSGNGTFVNTELVGKGKRRPLNNNSEIALSLSRNKVFVFFDLTVDDQSVYPKALRDEYIMSK-TLGSGACGEVKLAFERKTCKKVAIKII---SKRKFAIGSAREADPALNVETEIEILKKLNHP--CIIKIKNFFDAEDYYIVLELMEGGELFDKVV-GNKRLKEATCKLYFYQMLLAVQYLHENGIIHRDLKPENVLLSSQEEDCLIKITDFGHSKILGETSLMRTLCGTPTYLAPEVLVSVGTAGYNRAVDCWSLGVILFICLSGYPPFSEHRTQVSLKDQITSGKYNFIPEVWAEVSEKALDLVKKLLVVDPKARFTTEEALRHPWLQDEDMKRKFQDLLSEENESTALPQVLAQPSTSRKRPREGEAEGAETTKRPAVCAAVL |
3SHE Chain:A ((6-272)) | ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------AVTDDYQLSKQVLGLGVNGKVLECFHRRTGQKCALKLLYDSPKARQEVDHHWQASGGPHIVCILDVYENMHHGKRCLL------------IIMECMEGGELFSRIQE---AFTEREAAEIMRDIGTAIQFLHSHNIAHRDVKPENLLYTSKEKDAVLKLTDFGFAKET--------------------------EKYDKSCDMWSLGVIMYILLCGFPPFY-----------------GFPNPEWSEVSEDAKQLIRLLLKTDPTERLTITQFMNHPWI--------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3SHE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -141011 for 1633 contacts (-86.4/contact) +
2D Compatibility (PS) -22787 + (NN) -10594 + (LL) 16072
1D Compatibility (HY) -18800 + (ID) 4150
Total energy: -181270.0 ( -111.00 by residue)
QMean score : 0.469
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