Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MSYDVIISGGGLLGLITAVGLSNNS--VSVAVIEKNNLPRIIDDNRAFAISQGS-RKILEKLGIWQFIESE-AEPILDICILDENSPITVHYNHKMVSEEPMGYVINSTVIWNAINNNFLNKLNIYSL--HSYRTITCDAGYVEVTLGNNQKLISSLLICAEGKNSKLPGLFSMSIIKFDYKQ--SSIVFNVKHELHHQNLAVEQFF-PGGP--FAILPMKSGYTSSIVWTEKSEISK---MLMNLSEEEFIIELKKRFGSYLGEVKLD-GERKSYPLSFA-SAKKLYKSRVLLIGDAAHSIHPVAGQGLNLGIRDAESVVRQITAAKAFGIDVGSSYLLKKISRDRCLDNFTMALATDGLNRIFSNRIFCAKTLRNFGLMAVENSKFLKKRFIRHAMGFV |
3C4A Chain:A ((1-329)) | --MKILVIGAGPAGLVFASQLKQARPLWAIDIVEKNDE--QEVLGWGVVLPGRPGQHPANPLSYLDAPERLNPQFLEDFKLVHHN-EP-S-LM----STGVLLCGVERRGLVHALRDKCRSQ-GIAIRFESPLLEHG-----------ELPLADYDLVVLANGVNHKTAHFTEALVPQVDYGRNKYIWYGTSQL--FD-QMNLVFRTHGKDIFIAHAYKYSD-T-MSTFIVECSEETYARARLGEMSEEASAEYVAKVFQAELGGHGLVSQPGLGWRNFMTLSHDRCHDGKLVLLGDALQSGHFSIGHGTTMAVVVAQLLVKALCTE----DGV--PAALKRFEERALPLVQLFRGHADNSRVWFETVEEREFVQSFDARRKSLPPMPEALAQNLRYAL-- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3C4A.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -135495 for 2593 contacts (-52.3/contact) +
2D Compatibility (PS) -32807 + (NN) -1406 + (LL) 2064
1D Compatibility (HY) -6000 + (ID) 2550
Total energy: -176194.0 ( -67.95 by residue)
QMean score : 0.345
|
|
|