Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MRKTIFAFLTGLMMFGTITAASASPDSKNQTAKKPKVQTGIDTLLPDYKKQLKGKRIGLITNPAGVNTSLKSSVDILYENPDIKLTALFGPEHGVRGDAQAGDEVGSYIDEKTGVPVYSLYGKTKKPTPEMLKNVDILMFDIQDVGTRFYTYIYTMAYAMEAAKENGIPFMVLDRPNPQGGNHIEGPILEPEYASFVGLYPIPLKHGMTIGELASLFNKEF----SIDADLTVVKMKHWKRKMDFDDTRLPFVLPSPNMPTVESTFVYPATGLIEGTNISEGRGTTKPFELIGAPFIKSTELEETLNSLHLPGVTFRAASFTPTFSKHQGTLCHGVQLYVTDRDKFEAVKTGLS---VIKTIHDLYPEDFEFLSTGSFDKLAGNGWIRTKIENGTSVENIINSYEKTLQQFSKTRKKYLIY |
4JJA Chain:A ((20-368)) | ---------------------------------------------------LKNKRIAIFSNHTGM-VGNKHLLDILLEN-NFNVVAIFSPEHGFRGN---------TIDSKTGVPILSL-----KPSEASMKKFDILIVDIQDVGLRFYTYYISMVRLMDACAEYDRKILILDRPNPN-GHYVDGPILDMKYKSGVGGLPIPIVHGMTLGELALMVNGERWLPSSRICDVTVIPCKNYTHQTMY---RLP-IPPSPNLPNMKAIYLYPSICLFEGTPVSLGRGTTLPFQVYGHP--NMTGYNYNFTPRSIPG-----AKNPPQLNK----LCHGVNL--SNLSDEEIWKKGINLDYLIDAYHNLNMGDRFFRPF--FELLVGTDYVRKMIEGGKSADEIKARWKRDVERFKIQRKPYLLY |
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General information:
TITO was launched using:
| RESULT:
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Template: 4JJA.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -120933 for 2766 contacts (-43.7/contact) +
2D Compatibility (PS) -34673 + (NN) -14893 + (LL) 4364
1D Compatibility (HY) -31600 + (ID) 7150
Total energy: -204885.0 ( -74.07 by residue)
QMean score : 0.535
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