Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MDILRKGNKDLIKDINRYTVLNLIREKGEITRTEIAKKCDFGMSTLTYILDDLQQEGIILEGAETSSTGGRRAKLVRFNKDYGFVVSVKVEEEQLLFALTDLNAEIIENTSIPFSSEKKPEEAIELI--------AKNVKKMCGNRDMNHLLGVGIAISGLVNRKKGTVIRSTML--GWENVALEAMLHAHFPDIPVYVDKNINCYTLAELWLGEGKQSNNFATVSVGAGLGLSVVINRQIYYGAQGGAGEFGHTTIQPGGYKCHCGQKGCLEMYASEFYFRNRGEELKE---------AYPTSE-LNDFHFDKVAKSARAGDEMATELMGKMGEYLGYGIRNIINTFNPEKVIIVGEGLHHRDLFLTKIDEIASQNFFSGAGFETEITTTSLEDPAWLQGAALLVIHQLFQVPIYEEEQTLLR |
2YI1 Chain:A ((33-292)) | -------------------------------------------------------------------------------------LAVDLGGTNLRVAIVSMKGEIVKKYT-QFNP-KTYEERINLILQMCVEAAAEAVKLNC------RILGVGISTGGRVNPREGIVLHSTKLIQEWNSVDLRTPLSDTL-HLPVWVDNDGNCAALAERKFGQGKGLENFVTLITGTGIGGGIIHQHELIHGSSFCAAELGHLVVSLDGPDCSCGSHGCIEAYASGMALQREAKKLHDEDLLLVEGMS-----AVGALHL---IQAAKLGNAKAQSILRTAGTALGLGVVNILHTMNPSLVILSG------------------------------------------------------------------- |
|
General information:
TITO was launched using:
| RESULT:
|
Template: 2YI1.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
|
3D Compatibility (PKB) -119095 for 1867 contacts (-63.8/contact) +
2D Compatibility (PS) -25316 + (NN) -8336 + (LL) 11600
1D Compatibility (HY) -18000 + (ID) 4150
Total energy: -163297.0 ( -87.46 by residue)
QMean score : 0.426
|
|
|