Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MPSRTGPKMEGSGGRVRLKAHYGGDIFITSVDAATTFEELCEEVRDMCRLHQQHPLTLKWVDSEGDPCTVSSQMELEEAFRLARQCRDEGLIIHVFPSTPEQPGLPCPGEDKSIYRRGARRWRKLYRANGHLFQAKRFNRRAYCGQCSERIWGLARQGYRCINCKLLVHKRCHGLVPLTCRKHMDSVMPSQEPPVDDKNEDADLPSEETDGIAYISSSRKHDSIKDDSEDLKPVIDGMDGIKISQGLGLQDFDLIRVIGRGSYAKVLLVRLKKNDQIYAMKVVKKELVHDDEDIDWVQTEKHVFEQASSNPFLVGLHSCFQTTSRLFLVIEYVNGGDLMFHMQR-QRKLPEEHARFYAAEICIALNFLHERGIIYRDLKLDNVLLDADGHIKLTDYGMCKEGLGPGDTTSTF-CGTPNYIAPEILRGEE-----YGFSVDWWALGVLMFEMMAGRSPFDIITDNPDMNTEDYLFQVILEKPIRIP---RFLSVKASHVLKGFLNKDPKERLGCRPQTGFSDIKSHAFFRSIDWDLLEKKQALPPFQPQITDDYGLDNFDT-QFTSEPVQLTPDDEDAIKRIDQSEFEGFEYINPLLLSTEESV |
| 4AW2 Chain:A ((44-415)) | -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SPLRREKNILEYLEWAKPFTSKVKQMRLHR----EDFEILKVIGRGAFGEVAVVKLKNADKVFAMKILNKWEMLKRAETACFREERDVLVNGDS-KWITTLHYAFQDDNNLYLVMDYYVGGDLLTLLSKFEDRLPEEMARFYLAEMVIAIDSVHQLHYVHRDIKPDNILMDMNGHIRLADFGSCLKLMEDGTVQSSVAVGTPDYISPEILQAMEGGKGRYGPECDWWSLGVCMYEMLYGETPF-----YAESLVETYGKIMNHKERFQFPTQVTDVSENAKDLIRRLICS-REHRLG---QNGIEDFKKHPFFSGIDWDNIRNCE--APYIPEVSSPTDTSNFDVD-----------------SG-HHLPFVGFTYTSSCVLSDRSCL |
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General information:
TITO was launched using:
| RESULT:
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Template: 4AW2.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -167835 for 2698 contacts (-62.2/contact) +
2D Compatibility (PS) -36443 + (NN) -14584 + (LL) 13696
1D Compatibility (HY) -31600 + (ID) 6000
Total energy: -242766.0 ( -89.98 by residue)
QMean score : 0.466
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