Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MNRDQSDLHIDELLADPFGGNIEIPGSEAVKAEKEQVRLVDVLPEENKEKAIQLAGQIDHKNMQSIVLYGSQAQSKLLNFSHDMINHVQKKDVGEIGEILGELMKKLEQVNPDDLQSKKKGFLARMFGRVSSSLQEVLSKYQKTSVQIDRISLKLEHSKNALISDNKLLEQLYEKNKEYFAALNVYIAAGELKLEELKTKTIPELKQQAESSDHNQMAVQEVNDLIQFADRLDKRVHDLLLSRQITIQSAPQIRLIQNTNQALAEKIQSSIVTAIPLWKNQVAIALTLLRQRNAVDAQQKVSDTTNELLLKNAELLKTNTIETARANERGLVDIDTLKKVQESLISTLEETLTIQEEGRIKRRQAEEELMMMEGDLKQKLITIKER------------------------------------- |
5A5T Chain:A ((7-605)) | RPENALKRANEFLEVGKKQPALDVLYDVMKSKKHRTWQKIHEPIMLKYLELCVDLRKSHLAKEGLYQYKNICQQVNIKSLEDVVRAYLKLAEEKTEAAKEESQQMVLDIEDLDNIQTPESVLLSAVSGEDTQDRTDRLLLTPWVKFLWESYRQCLDLLRNNSRVERLYHDIAQQAFKFCLQYTRKAEFRKLCDNLRMHLSQIQRHHNQSTAI----NLNNPESQSMHLETRLVQLDSAISMELWQEAFKAVEDIHGLFSLS----KKPPKPQLMANYYNKVSTVFWKSGN--ALFHASTLHRLYHLSREMRKNLTQDEMQRMSTRVLLATLSIPITPERTD-----IARLLDMDGIIVEKQRRLATLLGLQAPPTRIGLINDMVR--FNVLQYVVPEVKDLYNWLEVEFNPLKLCERVTKVLNWVREQPEK-EPELQQYVPQLQSNTILRLLQQVAQIYQSIEFSRLTSLVP-FVDAFQLERAIVDAARHCDLQVRIDHTSRTLSFGSDLNYATREDAPIGPHLQSMPS-EQIRNQLTAMSSVLAKALEVIKPAHILQEKEEQHQLAVTAYLKNSRKEHQRILARRQTIEERKERLESLNIQREKEELEQREAELQKVR |
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General information:
TITO was launched using:
| RESULT:
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Template: 5A5T.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 99559 for 2446 contacts (40.7/contact) +
2D Compatibility (PS) -38968 + (NN) -8839 + (LL) 1664
1D Compatibility (HY) -7200 + (ID) 2600
Total energy: 43616.0 ( 17.83 by residue)
QMean score : 0.167
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