Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDLIPNLAVETWLLLAVSLVLLYLYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKMWGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLAEDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVTLKDIFGAYSMDVITGTSFGVNIDSLNNPQ-DPFVESTKKFLKFGFLDPLFLSIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDFLQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYELATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAIRLERTCKKDVEINGVF-IPKGS--MVVIPTYALHHDPKYWTEP-EEFRPERFSKKKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQIPLKLDTQGLLQPEKPIVLKVDSRDGTLSGE |
4DUE Chain:A ((89-456)) | ----------------------------------------------------------------------------------------------------------------------SWTHEKNWKKAHNILLPSFSQQAMKGYHAMMVDIAVQLVQKWER-LNADEHIEVPEDMTRLTLDTIGLCGFNYRFNSFYRDQPHPFITSMVRAL-----DEAMNKLQRA--DDPAYDE-NKRQFQED-IKVMNDLVDKIIADRKASGEQSD-DLLTHML---NGKDPETGEPLDDENIRYQIITFLIAGHESTSGLLSFALYFLVKNPHVLQKAAEEAARVLVDPV-PSYKQVKQLKYVGMVLNEALRLWPTAPAFSLYAKEDTVLGGEYPLEKGDELMVLIPQ--LHRDKTIWGDDVEEFRPERF-ENPSAIPQHAFKPFGNGQRACIGQQFALHEATLVLGMMLKHFDFEDHTNYELDIK-ETQ-LLKPEG-FVVKAKSKKIPLG-- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 4DUE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -164510 for 2797 contacts (-58.8/contact) +
2D Compatibility (PS) -38345 + (NN) -19137 + (LL) 8644
1D Compatibility (HY) -25200 + (ID) 5950
Total energy: -244498.0 ( -87.41 by residue)
QMean score : 0.317
|
|
|