M1D26

Prompt

1.2.1.10

Oxidoreductases. Acting on the aldehyde or oxo group of donors. With NAD(+) or NADP(+) as acceptor. acetaldehyde dehydrogenase (acetylating).

AI Generated Sequence

299 AAs
MSKKVKCAIIGSGNIGTDLMYKILRSDWLEPMAMVGIDPESDGLARAREMGIKTTAEGVDGLLPMVKDDIDIVFDATSAYVHAENSPKLAELGIKMIDLTPAAIGPYCVPAVNLREHLDAPNVNMVTCGGQATIPIVAAVSRVAPVPYAEIVASIASKSAGPGTRKNIDEFTKTTSRGIEKVGGAREGKAIIILNPAEPPLIMRDTIYCLTEDPDQRAITASIQAMVAEVQKYVPGYRLKNEPVFQDGVSSVFLEVEGAGDYLPKYAGNLDIMTAAAAKVAEGLAEGVAERVMARAAGA

Ligand/Cofactor

NAD(+)

C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)OP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C(N=CN=C54)N)O)O)O)O)C(=O)N

Validation Metrics

PLDDT87.8
NLMSIM95.0
AACOMP91.7
Seqdif (SeqID)24.5 (WP_003292099.1)
Structdif (F-Target)5.6 (4jn6 D)

ProtNLM

NameScore
Acetaldehyde dehydrogenase [acetylating]0.433
Acetaldehyde dehydrogenase0.294
1.2.1.100.257
Acetaldehyde dehydrogenase (Acetylating)0.002
Acetaldehyde dehydrogenase [acetylating] 10.001
Acetaldehyde dehydrogenase [acetylating] 20.001
Designed by MP, using an AMD MI250 GPU