Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKDFLEDYKKSVLERKSEGIPPLPLNAKQVEAVVEILMKDPTNAAFAKELLIHRVSPGVDEGAKVKAEFLAQLSQKKLECPHISALEATTLLGTMLGGYNVEPLIVGLESQDKNIAKESAKALKTTLLVYGSFDKIAAMSKTNALAKEVLESWANAEWFLNKEPLNECIEACVFKIDGETNTDDLSPASDAFTRSDIPLHAKAMLKNRIENYEQRIEAIKTKGVPVAYVGDVVGTGSSRKSATNSIMWHFGKDIPFVPNKRSGGIVIGGVIAPIFFATCEDSGALPIVADVKDLKEGDIIKIYPYKGEITLNDKVVSTFKLEPETLLDEVRASGRIPLIIGRGLTNKARKFLGLGESEAFKKPSAPKSDAKGYTLAQKIV-GHACGVKGILPG---AYCEPKVTTVGSQDTTGAMTRDEVKELASLKFDAPFVLQSFC---------HTAAYPKPSDVSLHATLPGFITQRGGVALHPGDGVIHTW-LNRMGLPDTLGTGGDSHTRFPLG---ISFPAGSGLVAFAAVTGTMPLNMPESVLVRFKGEMNPGITLRDLVNAIPYYAIKKGLLTVEKKGKINVFNGRILEI--EGLPDIKMEQAFELSDASAERSAAACVVRLNKEPMIEYLKSNIKLIDEMIASGYEDKETLKKRRDAMQAWVDKPVLLEPDSNAQYAAVIEIDVAEITEPILACPNDPDDVATLSEVLADTTGK-RPHAIDEVFIGSCMTN-IGHFRAFGEIVKNAP----PSQARLWVVPPSKMDEQELINEGYYAIFGAAGARTEVPGCSLCMG----NQARVRDNAVVFSTSTRNFDNRMGRG--AKVYLGSAELGAACALLGRI------------PTKEEYMN------LVSEKLESQKDKIYRYMNFNLMENFRL |
1ACO Chain:? ((2-528)) | --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RAKVAMSHFEPHEYIRYDLLEKNIDIVRKRLNRPLTLSEKIVYGHLDDPANQEIERGKTYLRLRPDRVAMQDATAQMAMLQFISSGLPKVAVPSTIHCDHLIEAQLGGEKDLRRAKDINQEVYNFLATAGAKYGVGFWRPGSGIIHQIILENYAYPGVLLIGTDSHTPNGGGLGGICIGVGGADAVDVMAGIPWELKCPKVIGVKLTGSLSGWTSPKDVILKVAGILTVKGG------------TGAIVEYHGPGVDSISCTGMATICNMGAEIGATTSVFPYN-HRMKKYLSK-------------------TGRADIANLADEFKDHLVPDSGCHYDQLIEINLSEL-KPHINGPFTPDLAHPVAEVGSVAEKEGWPLDIRVGLIGSCTNSSYEDMGRSAAVAKQALAHGLKCKSQFTITPGSEQIRATIERDGYAQVLRDVGGIVLANACGPCIGQWDRKDIKKGEKNTIVTSYNRNFTGRNDANPETHAFVTSPEIVTALAIAGTLKFNPETDFLTGKDGKKFKLEAPDADELPRAEFDPGQDTYQHPPKDSSGQRVDV |
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General information:
TITO was launched using:
| RESULT:
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Template: 1ACO.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -161727 for 4319 contacts (-37.4/contact) +
2D Compatibility (PS) -50915 + (NN) -10383 + (LL) 25292
1D Compatibility (HY) -7600 + (ID) 5000
Total energy: -210333.0 ( -48.70 by residue)
QMean score : 0.324
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