M2M49

Prompt

1.13.11.2

Oxidoreductases. Acting on single donors with incorporation of molecular oxygen (oxygenases). The oxygen incorporated need not be derived from O2. With incorporation of two atoms of oxygen. catechol 2,3-dioxygenase.

AI Generated Sequence

309 AAs
MPRPGVLRPGHVQLRVLDMAAALEHYRDVLGMEITERDEAGRVYLKGWTEVDHFSVVLREADEPGMDFMGFKVADEAGLRQLEADLTAYGCEVWGLPAGEAPRCGRRIRFHAPSGHHFELYADKEYTGKWGVTEANPEAWPRDLAGMAPTRFDHCLLYGDDLPATLDLFTRVFGFRLTEQVLDDAGVRIAQFLTCSAKAHDVAFIHRPEKGKLHHVAFWLETWEDVLRAADLISMTDTSIDIGPTRHGLTRGQTIYFFDPSGNRNECFGGGAYTYPDHKPVTWTAEDLGKRAIFYHRAVLNETFMSVFT

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

PLDDT88.4
NLMSIM85.0
AACOMP92.1
Seqdif (SeqID)21.3 (WP_009397178.1)
Structdif (F-Target)3.8 (1mpy D)

ProtNLM

NameScore
1.13.11.20.347
Catechol 2,3-dioxygenase0.240
CatO2ase0.212
Metapyrocatechase0.180
3,4-dihydroxyphenylacetate 2,3-dioxygenase0.001
Dioxygenase0.000
Designed by MP, using an AMD MI250 GPU