MV2JV

Prompt

4.2.1.3

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

AI Generated Sequence

500 AAs
MSDTFETRRTLEVGGEREYHYSRLEVAEAGLGDIGRLPKSLKVLLENLLRHEDGRTVTEADIRALAGWLGERGRRDEIAYRPARVLMQDFTGVPALVDLAAMRDAVAELGGDPQRINPLVPVDLVIDHSVMVDHFGTPDAFARNVEIEFERNRERYAFLRWGQKAFDNFRVVPPGTGICHQVNLEYLARVVWTREDGELAYPDTLVGTDSHTTMINGLGVLGWGVGGIEAEAAMLGQPVSMLIPEVVGFRLTGRLREGVTATDLVLTITQMLRKHGVVGKFVEFFGEGLAHLSVADRATIGNMAPEYGATCGIFPVDEVTLDYLRLTGRPEERIALVEAYAKAQGMWRDPGAPEPVYTDTLELDLGTVAPSLAGPKRPQDRVPLAGVKADFADFAEPQVGGKGFQRPADSGRRVPVEGRDYELGHGDVVIAAITSCTNTSNPSVMIAAGLVARKAVERGLTRKPWVKTSLAPGSQVVTDYLEASGLQPYLDEVGFNLVGY

Ligand/Cofactor

aconitate

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

Validation Metrics

PLDDT84.0
NLMSIM85.0
AACOMP92.4
Seqdif (SeqID)24.8 (HAF92384.1)
Structdif (F-Target)8.9 (2b3y B)

ProtNLM

NameScore
Aconitase0.379
Aconitate hydratase0.306
4.2.1.30.294
Aconitate hydratase AcnA0.009
2-methyl-cis-aconitate hydratase0.003
4.2.1.990.001
Designed by MP, using an AMD MI250 GPU