Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)
Input alignment information:
| Query sequence | MLKVSDLRLKYPNGQRKIFDHLNITIQDKEKVLLLGPSGCGKSTLLNVLSGIVPNLIELPMKYDELIVDPLSGVIFQDPDSQFCMPKVYEELAFVLENRQVPREDMDALIINALNMVNLNV-TPETYIKDLSGGMKQKLAIVETILQQSKTLFLDEPTAMLDVQATEDLWTKLIELWEDQTVVIVEHKVKHIWNHVDRVILMDYNGNIIAD-ECPEIILQKYVH-----LLSEYGV--WHPRAWEFAPSRVDFPTTNSHLLQFKNGRIIRGK--STLLSFSDLEIGLGEWITITGANGSGKTTLLESIMQLIKY-QGDVYFENQRLTK---------I-----KHAAKHMYLVYQNPELQ----------------------------------------------FITNSVYDEINIHFNH------------------------L-------------SKDQSDDETIQLLKLLDLQNV--KDQHPYELSIGQKRRLSVATALSSKADIIFLDEPTFGLDSHNTFQLIKLFQKRINLGQSIVMVTHDDEIIERYPSRRLKISDGALLDCDGDTNV |
| 2IW3 Chain:A ((435-979)) | --DLCNCEFSLAYGAKILLNKTQLRLKRARRYGICGPNGCGKSTLMRAIANGQVD-------GFPTQEECRTVYVEHDIDGTHSDTSVLDFVFESGV-------GTKEAIKDKLIEFGFTDEMIAMPISALSGGWKMKLALARAVLRNADILLLDEPTNHLDTVNVAWLVNYLNTCG--ITSITISHDSVFLDNVCEYIINYEGLK-LRKYKGNFTEFVKKCPAAKAYEELSNTDLEFKFPEP----GYLEGVKTKQKAIVKVTNMEFQYPGTSKPQITDINFQCSLSSRIAVIGPNGAGKSTLINVLTGELLPTSGEVYTHENCRIAYIKQHAFAHIESHLDKTPSEYIQWRFQTGEDRETMDRANRQINENDAEAMNKIFKIEGTPRRIAGIHSRRKFKNTYEYECSFLLGENIGMKSERWVPMMSVDNAWIPRGELVESHSKMVAEVDMKEALASGQFRPLTRKEIEEHCSMLGLDPEIVSHSRIRGLSGGQKVKLVLAAGTWQRPHLIVLDEPTNYLDRDSLGALSKALKEF---EGGVIIITHSAEFTKNLTEEVWAVKDGRMTPS------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 2IW3.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -257440 for 3708 contacts (-69.4/contact) +
2D Compatibility (PS) -45962 + (NN) -14500 + (LL) 2196
1D Compatibility (HY) -12400 + (ID) 4350
Total energy: -332456.0 ( -89.66 by residue)
QMean score : 0.390
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