MFA8I

Prompt

4.1.3.4

Lyases. Carbon-carbon lyases. Oxo-acid-lyases. hydroxymethylglutaryl-CoA lyase.

AI Generated Sequence

299 AAs
MSLPSSVKIVELGPRDGQNPEKTFIPTDVKVALIDRLAQAGFTHIEAGSFVSPSAVPQLADATELMAGIQRRPGVTYAALVPNLKGFDDAAAAGREEIAVFCSASESFSQKNINCSIEESLQRFAPVVRAARDHGIKVRGYVSTVLGCPYEGDVPPARVVAVAERLYDMGCYEISLGDTIGVATPQKVAALLDRVVAEIPTPRLAGHFHDTYGQALANIYASLEQGVRTFDASVAGLGGCPYAKGASGNVATEDVVYMLHGLGIGTGIDLPALAEASRWIAEQLGRPYSGKVIAAVRPA

Ligand/Cofactor

acetyl-CoA

CC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O

Validation Metrics

PLDDT96.7
NLMSIM85.0
AACOMP92.8
Seqdif (SeqID)32.8 (WP_076724197.1)
Structdif (F-Target)2.6 (1ydo A)

ProtNLM

NameScore
4.1.3.40.647
Hydroxymethylglutaryl-CoA lyase0.330
4.1.3.260.004
3-hydroxy-3-methylglutarate-CoA lyase0.003
3-hydroxy-3-isohexenylglutaryl-CoA/hydroxy-methylglutaryl-CoA lyase0.002
Pyruvate carboxyltransferase domain-containing protein0.002
Designed by MP, using an AMD MI250 GPU