Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKMRVYSLLFMMLFALSIGANAQVKFFTDVNSKQIKT-----LQVKVAGELISEPYIALGGEEQIEINFDGLGSGYTRYAYNV-VHCNADWTQSQLSPIEYMNGF-------QGTTIDDFANSIGTTTQYSNYRLLLPNDDVQFKVSGNYAIQVYNEDTPDQIIFTACFSVVEPVVNISASVSGNTDIDTNQSHQQVSFNINNKNFPITYPQTDLKIFVYQDNRRDNAVTDLQPMSILENQISYTYNRNLIFPAGNEYRRMEFLSNKYNGMHVENISFHNPYYNVELMTDYRRDKGTYQYDQDQDGRFFIRCSDCNDPDTEADYYIVHFTLACDPLPDGSVYLNGELFNNVLDEKSKMGYNFETKQYEKAVLLKQGSYNYQYLFVPTGSSVGQTGPIEGNYYQTQNEYSI-------YVYYRPMGARYDRLIGVTTVRNEMQVF |
1KK1 Chain:A ((6-410)) | --SRQAEVNIGMVGHVDHGKTTLTKALTGVWTDSEELRRGITIKIGFADAEIRRCPNCGRYSTSPVCPYCGHETEFVRRVSFIDAPGHEALMTTMLAGASLMDGAILVIAANEPCPRPQTREHLMALQIIGQKNIIIAQNKIEL-VDKEKALENYRQIKEFIEGTVAENA---PIIPISALHGANIDVLVKAIEDFIPTPKRDPN-----KPPKMLVLRSFDVNKPGKLVGGVLDGSIVQG-KLKVGDEIEIRPGVPYEEHGRIKYEPITTEIVSLQA-----------------GGQFVEEAYPGGLVGVGTKLDPYLTKGDLMAGNVVGKPGKLPP--VWDSLRLEVHLLERVVEQELKVEP--------IKRKE--VLLLNVGTARTMGLVTGLGKDEIEVKLQIPVCAEPGDRVAISRQIGSRW-RLIGYGIIKE----- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 1KK1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -68284 for 3010 contacts (-22.7/contact) +
2D Compatibility (PS) -39282 + (NN) -1000 + (LL) 3680
1D Compatibility (HY) -8000 + (ID) 2450
Total energy: -115336.0 ( -38.32 by residue)
QMean score : 0.090
|
|
|