Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKIAAFDIGGTALKMGVVLPHGEIILTKSAEISGSD-GDQ----ILAEMKVFL----AENTDVTGIAVSAPGYVNPKTGLITMGGAIRRFDNFNLKEWLEAETGLPVAIENDANCALLAEKWLGKGQDLDDFLCLTIGTGIGGGIFSNGELVRGGRFRAGEFGYMFSERPGAFRPGKYTLNETTTMLVLRRQYAELTGRPLEEITGEEIFANYDAHDAVSERLITEFYTGICTGLYNLIYLFDPTHIFIGGGITSR-PTFIAELKHHMESFGL--RDTIIETATHKNQAGLLGAVYHFLQEENRHE |
2HOE Chain:A ((87-375)) | AYVLGIEVTRDEIAACLIDASMNILAHEAHPLPSQSDREETLNVMYRIIDRAKDMMEKLGSKLSALTVAAPGPIDTERGIIIDPRNFP-LSQIPLANLLKEKYGIEVWVENDADMGAVGEKWYTK--RDDSFAWILTGKGIGAGIIIDGELYRGENGYAGEIGYTRVFNGN----EYVFLEDVCNENVVLKHVLS--------MGFS-LAEARDSGDVRVKEYFDDIARYFSIGLLNLIHLFGISKIVIGGFFKELGENFLKKIKIEVETHLLYKHSVDMSFSKVQEPVIAFGAAVHALENYLE-- |
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General information:
TITO was launched using:
| RESULT:
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Template: 2HOE.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -195610 for 2292 contacts (-85.3/contact) +
2D Compatibility (PS) -29937 + (NN) -18449 + (LL) 936
1D Compatibility (HY) -16800 + (ID) 3000
Total energy: -262860.0 ( -114.69 by residue)
QMean score : 0.493
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