Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MTIYHFVGIKGSGMSALAQILHDKGFQVQGSDVDKYFFTQKALEEKQIPIMT-FSADNIQE--GLTIIAGNAFPDTHEEIERALELGLSVIRYHKFLGQ-LIDGYTSIAITGSHGKTSTTGLLSHVV--GAIRPTSYLIG---DGTGSGTK-----------DAEYFALEACEY-------QRHFLAYKPTYAIMTNIDWDHPDYFKSVDDVFNAFETLGKQV-KKAVFALGDDAELRKLTLD----IPIIYFGFGEENEFQAKNVIKETTGTKFDVYHREEFLSSFEIPAYGDHNVLNALSVIALCDYEGLPVEDVKNELKTFEGVKRRFSITEKGNQVLVDDYAHHPSEIRATVNAARQKYPDKKVVAVFQPHTFTRTRTFLQGFADSLNLADEVYLCDIFGSAREKTGNLTIADLAHKTKGNHIIKEEHTEELLKYPEAVILFMGAGDVQKFQAAYEKVLDHEFLTEADLKKSAIN |
3EAG Chain:A ((20-326)) | ----------------LAAIAKEAGFEVSGCDAKMYPPMSTQLEALGIDVYEGFDAAQLDEFKADVYVIGNVAKRGMDVVEAILNLGLPYISGPQWLSENVLHHHWVLGVAGTHGKTTTASMLAWVLEYAGLAP-GFLIGGVPENFGVSARLPQTPRQDPNSQSPFFVIEADEYDTAFFDKRSKFVHYRPRTAVLNNLEFDHADIFADLGAIQTQFHYLVRTVPSEGLIVCNGRQQSLQDTLDKGCWTPVEK--FGTEHGWQAGEANADGS---FDVLLDGKTAGRVKWDLMGRHNRMNALAVIAAARHVGVDIQTACEALGAFKNVKR------------------------------------------------------------------------------------------------------------------------------------------------------ |
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General information:
TITO was launched using:
| RESULT:
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Template: 3EAG.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -169598 for 2220 contacts (-76.4/contact) +
2D Compatibility (PS) -29558 + (NN) -12278 + (LL) 12120
1D Compatibility (HY) -19200 + (ID) 4050
Total energy: -222564.0 ( -100.25 by residue)
QMean score : 0.464
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