Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTSTRQAGEATEASVRWRAVLLAAVAACAACGLVYELALLTLAASLNGGGIVATSLIVAGYIAALGAGALLIKPLLAHAAIAFIAVEAVLGIIGGLSAAALYAAFAFLDELDGSTLVLAVGTALIGGLVGAEVPLLMTLLQRGRVAGAADAGRTLANLNAADYLGALVGGLAWPFLLLPQLGMIRGAAVTGIVNLAAAGVVSIFLLRHVVSGRQLVTALCALAAALGLIATLLVHSHDIETTGRQQLYADPIIAYRHSAYQEIVV---TRRGDDLRLYLDGGLQFCTRDEYRYTESLVY--PAVSDGARSVLVLGGGDGLAARELLRQPGIEQIVQVELDPAVIELARTTLRDVNAGSLDNPRVHVVIDDAMSWLRGAAVPPAGFDAVIVDLRDPDTPVLGRLYSTEFYALAARALAPGGLMVVQAGSPYSTPTAFWRIISTIRSA-GYAVTPY------HVHVPTFGDWGFALARLTDIAPTPAVPSTAPALRFLDQQVLEAATVFSGDIRPRTLDPSTLDNPHIVEDMRHGWD |
4UOE Chain:A ((29-224)) | -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SKYQNVLVFESTTYGK--VLVLDGVIQLTEKDEFAYHEMMTHVPMTVSKEPKNVLVVGGGDGGIIRELCKYKSVENIDICEIDETVIEVSKIYFKNISCGYED-KRVNVFIEDASKFLENVT---NTYDVIIVDSSDPIGPA-ETLFNQNFYEKIYNALKPNGYCVAQCES-------LWIHVGTIKNMIGYAKKLFKKVEYANISIPTY-------------------------------------------------------------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 4UOE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -102138 for 1480 contacts (-69.0/contact) +
2D Compatibility (PS) -21068 + (NN) -15056 + (LL) 26712
1D Compatibility (HY) -16800 + (ID) 3450
Total energy: -131800.0 ( -89.05 by residue)
QMean score : 0.405
|
|
|