Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------MQIIKRDGQIVEFDPEKI-YQAILKAAQTVYVLDESLRQDLAQVTKKVILDLEDAQVERPTINMIQSL--------VENRLLDAGYIHTAEHYISYRLQRDLERNGYDDQITVHLHFEKIK------------ |
4CR2 Chain:S ((126-478)) | KTIEVTAEINCFMHLLVQLFLWDSKELEQLVEFNRKVVIPNLLCYYNLRSLNLINAKLWFYIYLSHETLARSSEEINSDNQNIILRSTMMKFLKIASLKHDNETKAMLINLILRDFLNNGEVDSASDFISKLEYPHTDVSSSLEARYFFYLSKINAIQLDYSTANEYIIAAIRKAPHNSKSLGFLQQSNKLHCCIQLLMGDIPELSFFHQSNMQKSLLPYYHLTKAVKL-GDLKKFTSTITKYKQLLLKDDT-YQLCVRLRSNVIKTGIRII-SLTYKKISLRDICLKLNLDSEQTVEYMVSRAIRDGVIEAKINHEDGFIETTELLNIYDSEDPQQVFDERIKFANQLHDEYLVS |
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General information:
TITO was launched using:
| RESULT:
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Template: 4CR2.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -9923 for 619 contacts (-16.0/contact) +
2D Compatibility (PS) -11301 + (NN) -4318 + (LL) 292
1D Compatibility (HY) -4000 + (ID) 1150
Total energy: -30400.0 ( -49.11 by residue)
QMean score : 0.099
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