MB0WJ

Prompt

4.2.1.3

Lyases. Carbon-oxygen lyases. Hydro-lyases. aconitate hydratase.

AI Generated Sequence

896 AAs
MSSSSNFNTLKTLKVDGKKYHYFSLPQLAKEGLGDISRLPYSIKVLLENVLRNEDGKKVTKDHIEKIANWLNTNKSDTEIAFRPARVLMQDFTGVPAVVDLAAMRGAVKKLGGNPEKINPLVPVDLVIDHSVQVDHFGKPDAFEKNMELEFQRNGERYKFLKWGQKAFDNFRVVPPGTGICHQVNLEYLGKVVWTEKNGEIYYPDTLVGTDSHTPMINGIGVVGWGVGGIEAEAAMLGQPVSFLIPEVVGFKLTGKLKEGVTATDLVLTITQMLRKQGVVGKFVEFYGEGLSHLPLADRATIGNMAPEYGATCGFFPVDEVTLDYLRLTGRSEEQIALVEAYLKAQGMWRNPEGEPIYTDTLELDLGTVTPSLAGPKRPQDRIPLSSVKDAFADALEKQPVGNGFGLKPESDLKKFEMENGETYELKHGDVVIAAITSCTNTSNPSVMIAAGLLAKKAVEKGLKKKPWVKTSLAPGSRVVTEYLEKAGLQPYLDKLGFNLVGYGCTTCIGNSGPLPEPINEAITENDLVAAAVLSGNRNFEGRIHPLVKANYLASPPLVVAYAIAGTVNIDLTKEPIGQDKDGKPVYLKDIWPSSEEIHKVMKTVVNPDMFRKEYAEVFKNNELWKNLETEGSQLYAWDPNSTYIRNPPFFEGMTMEPGPVSDIKGARVLGILGDSITTDHISPAGSIKKDSPAGKYLLENGVEKADFNSYGSRRGNHEVMMRGTFANIRIKNKMLGPVEGGYTIHYPSGEQMSIYDAAMKYQAEGTPLVIFAGKEYGMGSSRDWAAKGTNLLGVKAVIAESFERIHRSNLVGMGVLPLQFKEGDSRETLGLTGKETFDINLGENLKPQKMTKVTVKRADGSTVEFQVLCRIDTTVEIDYYKHGGILPYVLRNLIA

Ligand/Cofactor

aconitate

C(C(=CC(=O)O)C(=O)O)C(=O)O

Validation Metrics

PLDDT83.9
NLMSIM85.0
AACOMP93.8
Seqdif (SeqID)31.0 (WP_288412552.1)
Structdif (F-Target)4.1 (2b3y B)

ProtNLM

NameScore
Aconitase0.388
Aconitate hydratase0.328
4.2.1.30.273
Aconitate hydratase AcnA0.005
2-methyl-cis-aconitate hydratase0.001
Aconitate hydratase 10.001
Designed by MP, using an AMD MI250 GPU