Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MGNASNDSQSEDCETRQWLPPGESPAISSVMFSAGVLGNLIALALLARRWRGDVGCSAGRRSSLSLFHVLVTELVFTDLLGTCLISPVVLASYARNQTLVALAPESRACTYFAFAMTFFSLATMLMLFAMALERYLSIGHPYFYQRRVSRSGGLAVLPVIYAVSLLFCSLPLLDYGQYVQ--YCPGTWCFIRHGRT-AY-LQLYATLLLLLIVSVLACNFSVILNLIRMHRRSRRSRCGPSLG---------------------------------------------SGRGG-----------------------------------------------------------------------------PGA-----------RRRGERVSMAEETDHLILLAIMTITFAVCSLPFTIFAYMNETSS--RKEKWDLQALRFLSINSIIDPWVFAILRPPVLRLMRSVLCCRISLRTQDATQTSCSTQSDASKQADL |
3UON Chain:A ((22-457)) | -------------------EVVFIVLVAGSLSLVTIIGNILVMVSIKVN-----------RHLQTVNNYFLFSLACADLIIGVFSMNLYTLYTV-IGYWPL---GPVVCDLWLALDYVVSNASVMNLLIISFDRYFCVTKPLTYPVKRTTKMAGMMIAAAWVLSFILWAPAILFWQFIVGVRTVEDGECYIQFFSNAAVTFGTAIAAFYLPVIIMTVLYWHISRASKSRINIFEMLRIDEGLRLKIYKDTEGYYTIGIGHLLTKSPSLNAAKSELDKAIGRNTNGVITKDEAEKLFNQDVDAAVRGILRNAKLKPVYDSLDAVRRAALINMVFQMGETGVAGFTNSLRMLQQKRWDEAAVNLAKSRWYNQTPNRAKRVITTFRTGTWDAYPPPSREKKVTRTILAILLAFIITWAPYNVMVLINTFCAPCIPNTVWTIGYWLCYINSTINPACYALCNATFKKTFKHLLM--------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3UON.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -245842 for 2139 contacts (-114.9/contact) +
2D Compatibility (PS) -30504 + (NN) -10663 + (LL) 2864
1D Compatibility (HY) -18800 + (ID) 1700
Total energy: -304645.0 ( -142.42 by residue)
QMean score : 0.384
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