Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MNGEAICSALPTIPYHKLADLRYLSRGASGTVSSARHADWRVQVAVKHLHIHTPLLDSERKDVLREAEILHKARFSYILPILGICNEPEFLGIVTEYMPNGSLNELLHRKTEYPDVAWPLRFRILHEIALGVNYLHNMTPPLLHHDLKTQNILLDNEFHVKIADFGLSKWRMMSLSQSRSSKSAPEGGTIIYMPPENYEPGQKSRASIKHDIYSYAVITWEVLSRKQPFEDVTNPLQIMYSVSQGHRPVINEESLPYDIPHRARMISLIESGWAQNPDERPSFLKCLIELEPVLRTFEEITFLEAVIQLKKTKLQSVSSAIHLCDKKKMELSLNIPVNHGPQEESCGSSQLHENSGSPETSRSLPAPQDNDFLSRKAQDCYFMKLHHCPGNHSWDSTISGSQRAAFCDHKTTPCSSAIINPLSTAGNSERLQPGIAQQWIQSKREDIVNQMTEACLNQSLDALLSRDLIMKEDYELVSTKPTRTSKVRQLLDTTDIQGEEFAKVIVQKLKDNKQMGLQPYPEILVVSRSPSLNLLQNKSM |
4ITJ Chain:A ((12-290)) | ------------MKSSDFLE--------FGKVSLAFHRTQG-LMIMKTVYKG-PNCIEHNEALLEEAKMMNRLRHSRVVKLLGVIIEEGKYSLVMEYMEKGNLMHVLKAEM---STPLSVKGRIILEIIEGMAYLHGKG--VIHKDLKPENILVDNDFHIKIADLGLASFKMWSKLN----------GTLYYMAPEHLNDVN-AKPTEKSDVYSFAVVLWAIFANKEPYENAIAEQQLIMAIKSGNRPDVD--DITEYCP--REIISLMKLCWEANPEARPTFPGIEEKFRPFYLSQLE------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 4ITJ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -162016 for 1952 contacts (-83.0/contact) +
2D Compatibility (PS) -26884 + (NN) -15582 + (LL) 16520
1D Compatibility (HY) -23200 + (ID) 4000
Total energy: -215162.0 ( -110.23 by residue)
QMean score : 0.407
|
|
|