Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTLYLDGETLTIEDIKSFLQQQSKIEI--IDDALERVKKSRAVVERIIENEETVYGITTGFGLFSDVRIDPTQYNELQVNLIRSHACGLGEPFSKEVALVMMILRLNTLLKGHSGATLELVRQLQFFINERIIPIIPQQGSLGASGDLAPLSHLALALIGEG---KVLYRGEEKDSDDVLRELNRQPLNLQAKEGLALINGTQAMTAQGVISYIEAEDLGYQSEWIAALTHQSLNGIIDAYRHDVHSVRNFQEQINVAARMRDWLEGSTLT-TR----QAEIRVQDAYTLRCIPQIHGASFQVFNYVKQQLEFEMNAANDNPLIFEEANETFVISGGNFHGQPIAFALDHLKLGVSELANVSERRLERLVNPQLNGDLPAFLSP--EPGLQSGAMIMQYAAASLVSENKTLAHP-ASVDSITSSANQEDHVSMGTTAARHGYQIIENARRVLAIECVIALQAAELKGV---------EGLSPKTRRKYEEFRSIVPSIT--H---------DRQFHKDIEAVAQYLKQSIYQTTACH |
2NYN Chain:A ((25-558)) | -NVIIGNQKLTINDVARVARNGTLVSLTNNTDILQGIQASCDYINNAVESG-----------------ISREQASELQTNLVWFLKTGAGNKLPLADVRAAMLLRANSHMRGASGIRLELIKRMEIFLNAGVTPYVYEFGSIG---DLVPLSYITGSLIGLDPSFKVDFNGKEMDAPTALRQLNLSPLTLLPKEGLAMMNGTSVMTGIAANCVYDTQILTAIAMGVHALDIQALNGTNQSFHPFIHNSKPHPGQLWAADQMISLLANSQLVRDELDGK-----IQDRYSLRCLPQYLGPIVDGISQIAKQIEIEINSVTDNPLIDVDN--QASYHGGNFLGQYVGMGMDHLRYYIGLLAKHLDVQIALLASPEFSNGLPPSLLGNRERKVNMGLKGLQICGNSIMPLLTFYGNSIADRFPTHAEQFNQNINSQGYTSATLARRSVDIFQNYVAIALMFGVQAVDLRTYKKTGHYDARACLSPATERLYSAVRH-VVGQKPTSDRPYIWNDNEQGLDEHIARISADIAAGGVIVQA-- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2NYN.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -197394 for 4174 contacts (-47.3/contact) +
2D Compatibility (PS) -50983 + (NN) -24745 + (LL) 2012
1D Compatibility (HY) -28000 + (ID) 6750
Total energy: -305860.0 ( -73.28 by residue)
QMean score : 0.510
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