Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ------MDRGEKIQLKRV---FGYWWGTSFLLINIIGAGIFVSPKGVLAYSCMNVGVSLCVWAGCA----ILAMTSTLCSAEISISFPCSGAQYYFLKRYFGSTVAFLNLWTSLFLGSGVVAGQALLLAEYSIQPFFPSCSVPKLPKKCLALAMLWIVGILTSRGVKEVTWLQIASSVLKVSILSFISLTGVVFLIRGKKENVERFQNAFDAELPDISHLIQAIFQGYFAYSGGACFTLIAGELKKPRTTIPKCIFTALPLVTVVYLLVNISYLTVLTPREILSSDAVAITWADRAFPSLAWIMPFAISTSLFSNLLISIFKSSRPIYLASQEGQLPLLFNTLNSHSSPFTAVLLLVTLGSLAI-ILTSLIDLINYIFFTGSLW----SILLMIGILRRRYQEPNLSIPYKVFLSFPLATIVIDVGLVVIPLVKSPNVHYVYVLLLVL----SGLLFYIPLIHFKIRLAWFEKMTCYLQLLFNICLPDVSEE |
4US3 Chain:A ((10-450)) | GREQWASRLGFILAAMGSAVGLGNIWRFSYVTGENGGAAFLLVYLGFIALIGIPIVLAEFTIGRRAQSDAVGSFEKLAPGKPWKVAGLMGVAAGFLILSFYGVIAGWILFYLFNYITGQLWSAPAEGFGGF-FEGFIANPTLPLFWQALFMIATIWIVAIGVKKGIERSNKILMPLLGVLLIALAIYSLT-----LGGAKEGLAFLFSPDWSALKDPGVYLAAISQAFFTLSLG--------------------------------MGALITYGSYVSKDSRLPGAAVSVAGLDTAFAIIAGIMIFPAVFALGLS------PSGGPGLVFVV---LPDIFDSIRL--GPIVGIAFFILLGAAALSSAVSLLEVPVAYFMRKFDWSRKQAAITLGVIITLLGIPSSLSFGVLGEVTIIPGLNIFDSVDFIASSVFLPLGGMIIALFIGWGWKTSDALAESDLTDSVWGKLWILSLRFIAPIAILIVFLSAF-- |
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General information:
TITO was launched using:
| RESULT:
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Template: 4US3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -427174 for 3790 contacts (-112.7/contact) +
2D Compatibility (PS) -42622 + (NN) -5363 + (LL) 4488
1D Compatibility (HY) -25600 + (ID) 3650
Total energy: -499921.0 ( -131.91 by residue)
QMean score : 0.255
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