Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKERTTMMSNLKKFGLAFLSVILLVNVIFQTNFVKAATNYGSDFLKTVELLDADGNPQTDFGYYDSIKVHYTWEIPNSTNVKEGDTMEFVLPPELKI----VTDLDFSLKDHDGNTVGHVIAKKSTGQVVITFTDFVEKNSNISGYLDFWTNWDKSLVEGN-ENVPVEFPVNGTTETIDVGVGGKNQIDPDESLYKYGWADAENPELIQWVVRVNYSKQNIQNAVYEDFIGPKQVVDFNSIKAFHGEFDPD-------DNFTPGAEVPSSAITQTTDGFKVDLGNLTDSVKISYYTTSTDNGASPNYTNKGQLTGDNFIKQEIEVATPTSGGGGGGEGTTGSVELTKTDDSSQKNPLEGAEFKLVNGAGATVQTGLKTNADGKLAISNLKYDTYQLIETKAPQGYVLDASPVKFTIDDTHQSLFVSKENTAIKGSVSLEKVDRDTKSLLADAEFELQDKDGNTLKTNLKTDQKGKLTVADLLPGEYQFVETKAPTGYILDTTPLKFKISTEALNVTVTKENTKKPEIPKVPVPPKKPEKPDKIISEDSKQTALPKTGDSPLVNGWGLLLVAISASGLIALRRK |
3IRP Chain:X ((2-419)) | -----------AQSGRNVNHLVFANTSYEILG---------------------GGKKYNQVFMTMDGKLKIKIDYTVDDSVVEGDYFTVDFGKYIHPGTSRKPYRVNNIHDANGRTIAIGSYDSATNTAKYTFTNYVDIYNNVRGSFSLLSWPFKELVTTDKQSVPVGITVAGEDYTQNVIFNYGNRTVP-----VISDINYLTKDFAEFTTYINQNRAFNTGSKVRLSGQGFKFTSPDEIEVYKVLNNSQFRDSFSPDYANLTQVRNPKIIINSDGSATVDLGDIGTLGYIIRSKPNTLPDFSG---------------------------------------------------------------IGVLKSEYTFTNNKNQRDTRAHASSIQFVRAELAGFGGFGGYVWFDKNNDGVQN---------------------DSNAAAAGITVNLLDPTGIRLATTT-TDITGHYNFDNLTNGNYL-VEFVMPEGYIPTQANSTVDDKD------SDVVFENGRYIAHVTIKDADNMTIDAGLVSD------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3IRP.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) 18129 for 3195 contacts (5.7/contact) +
2D Compatibility (PS) -44427 + (NN) -24568 + (LL) 8516
1D Compatibility (HY) -4800 + (ID) 3300
Total energy: -50450.0 ( -15.79 by residue)
QMean score : 0.212
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