Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKQEKVQDLVNQMTLDEKIAQCLQLSPFLFKGTNKNAELTGPLLQEMKLTDAHTENAGSVLGSSSAL----DMI-GIQEAYLKTNRLGIPLVFMADVIHGYK-----TVFPIPLALGCSFDRETVRVMAEVSALEATADGHHVTFSPMLDLVRDPRWGRVMESTGEDPFLNSELGKAMVDGYQGDASK-------LDGNFDRMAACVKHFAAYGAAEAGLEYNTVNMSTRELYQNYLPAYHAAIQAGAKLVMTAFNVVDGVPATMNKWLNRDVLRGEMDFDGVLISDWGAVAEVINHGTARNPKEAAQFSMEAGVDLEMMTTCY---IHELKGLIEEGKLSESLLDEAVLRMLHLKNDLGLFEDPYRGLKNNDRTKDILTDDSRGKARAAGVESAVLLENKNR-----LLPLAKET-KIALVGPLASSPDI-LGGWNVYGEEKDG-INVETGLREVFETVEVISTEYTEFSDEDKVAVKAAVQNMDVVVLALGEKNEWGGEAGSLATIRLPEAQYELAKFVQTLEKPVVITLFNGRPLEVKELAESSDALLELWFPGTEAGRVTADLLSGASNPSGKLSMSFPQTTGQIPVYYNHLRTGRPQTPENKGERYVSHYLDIPNEPFYPFGYGKSYSEFELKTSSLPKELNLGEPLHVEVTIKNISDIAGKEVIQVYLQDVTASISRPVKELKAFEKVALQAGEEKTVTFELTSEAFSFYNHQLEKVQEPGLHRIFVGTSSEDVDAFELEVGGYV |
3WLL Chain:A ((13-596)) | --EDRVADLLGRMTLAEKIGQMTQIERLVATPDVLRDNFIGSLL----------SGGGSVPRKGATAKEWQDMVDGFQKACMST-RLGIPMIYGIDAVHGQNNVYGATIFPHNVGLGATRDPYLVKRIGEATALEVRATGIQYAFAPCIAVCRDPRWGRCYESYSEDRRIVQSMTE-LIPGLQGDVPKDFTSGMPFVAGKNKVAACAKHFVGDGGTVDGINENNTIINREGLMNIHMPAYKNAMDKGVSTVMISYSSWNGVKMHANQDLVTGYLKDTLKFKGFVISDWEGI-DRITTPAGSDYSYSVKASILAGLDMIMVPNKYQQFISILTGHVNGGVIPMSRIDDAVTRILRVKFTMGLFENPY---ADPAMAEQLGKQEHRDLAREAARKSLVLLKNGKTSTDAPLLPLPKKAPKILVAGSHADNLGYQCGGWTIEWQGDTGRTTVGTTILEAVKAAVDPSTVVVFAENPDAEFVKSG--GFSYAIVAVGE-HPYTETKGDNLNLTIPEPGLSTVQAVCGGVRCATV-LISGRPVVVQPLLAASDALVAAWLPGSEGQGVT-DALFGDFGFTGRLPRTWFKSVDQLPM--------------NVGD---AHY-----DPLFRLGYG-------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3WLL.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -222120 for 5296 contacts (-41.9/contact) +
2D Compatibility (PS) -58921 + (NN) -18485 + (LL) 12132
1D Compatibility (HY) -36000 + (ID) 9100
Total energy: -332494.0 ( -62.78 by residue)
QMean score : 0.460
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