Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | --MTQTVNVIGAGLAGSEAAYQLAERGIKVNLIEMRPVKQTP------AHHTDKFAELVCSNSLRGNALTNGVGVLKEEMRRLNSIIIEAADKARVPAGGALAVDRHDFSGYITETLKN-----HENITVINEEINAIPDGYTIIATGPLTTETLAQEIVDITGKDQLYFYDAAAPIIEKESIDMDKVYLKSRYDKGE--------------------------------AAYLNCPMTEDEFNRFYDAVLEAEVAPVNSFEKE---------KYFEGCMPFEVMAERGRKTLLFG-------PMKPVGLEDPKTGKRPYAVVQLRQDDAAGTLYNIVGFQTHLKWGAQKEVIKLIPGLENVDIV-----RYGVMHRNTFINSPDVLNEKYELISQPNIQFAGQM--------------TGVEGYVESAASGLVAGINLAHKILGKGEVVFPRETMI--------GSMAYYISHAKNNKNFQPMNANFGLLPSLETRIKDKKERYEAQANRALDYLENFKKTL------------------------------ |
3I3L Chain:A ((20-586)) | HMTRSKVAIIGGGPAGSVAGLTLHKLGHDVTIYERSAFPRYRVGESLLPGTMSILNRLGLQEKIDAQNYVKKPSATFLWGQDQAPWTFSFAAPAPWVFDHAVQVKREEFDKLLLDEARSRGITVHEETPVTDVDLSDPDRVVLTVRRGGESVTVESDFVIDAGGSGGPISRKLGV---RQYDEFYRNFAVWSYFKLKDPFEGDLKGTTYSITFEDGWVWMIPIKDDLYSVGLVVDRSKSAEVREQGADAFYSSTLAKCAKAMDILGGAEQVDEVRIVQDWSYDTEVFSADRFFLCGDAACFTDPLFSQGVHLASQSAVSAAAAIDRITRHGDEKDAVHAWYNRTYREAYEQYHQFLASFYTFASFTEPDSEFWRKRRITESDDDRLTRKKWFESFRDRASTMIAIGRHQRPELSDDFSEAELNPARVRWISDLTKRLNSITRFKWTGGKAVLKQHYRVEPIGFRLEQREVLANGEGLDMAQYPMDDEARQIFQDLAEEEFGYKTLVKRLGAVGRQELSTQIVVRLMEAGLLTGYDAQGEKVFVQGRLHFGGVG |
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General information:
TITO was launched using:
| RESULT:
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Template: 3I3L.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -19581 for 3174 contacts (-6.2/contact) +
2D Compatibility (PS) -45198 + (NN) 2063 + (LL) 268
1D Compatibility (HY) 1200 + (ID) 2250
Total energy: -63498.0 ( -20.01 by residue)
QMean score : 0.184
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