Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDNNEKEKSKSELLVVTGLSGAGKSLVIQCLE---D-----MGYFCVDNLPPVLLPKFVELMEQGNPSLRKVAIAIDLRGKELFNSLVAVVDKVKSESDV-IIDV---MFLEASTE--------KLISRYKETRRAHPLMEQGKRS--LINAINDEREHLSQIRSIANFVID--TTKLSPKELKERIRRYYEDEE-FETFTINVTSFGFKHGIQMDADLVFDVRFLPNPYYVVDLRPLTGLDKDVYNYVMKWKETEIFFEKLTDLLDFMIPGYKKEGKSQLVIAIGCTGGQHRSVALAERLGNYLNEVFEYNVYVHHRDAHIESGEKK |
3WMG Chain:A ((369-566)) | LRGISLTIPNGKTVAIVGGSGAGKSTIIQLLMRFYDIEPQGGGLLLFDGTPAWNYDFH--------ALRSQIGLVSQEPV--LFSG--TIRDNILYGKRDATDEEVIQALREANAYSFVMALPDGLDTEVG--ERGLALSGGQKQRIAIARAILKHPTLL---------CLDESTSALDAES-EALVQEALDRMMASDGVTSVVIAHRL--STVARADLILVMQ-------------------------------------------------------------------------------------------------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 3WMG.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -7145 for 1181 contacts (-6.0/contact) +
2D Compatibility (PS) -18123 + (NN) -1482 + (LL) 9340
1D Compatibility (HY) -4400 + (ID) 1700
Total energy: -23510.0 ( -19.91 by residue)
QMean score : 0.219
|
|
|