MP5M5

Prompt

1.13.11.16

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. 3-carboxyethylcatechol 2,3-dioxygenase.

AI Generated Sequence

364 AAs

MTAHLCPVLSHPLSGYVDPAHAELIAEVDAALAAREGFVAFDHPLVVLFSPDHYNGSFYDFLPPFCIGMKATAIGDYGSYAGPLRVPVELAEACAAHVWDEGIDLCFSPRMQVDHGFAQPLEHLCGGLDTRPVVPVFINAVAEPLGLAQRARALGEGIGRFYATLGKRVLFIGSGGLSHHPPPPPLAKPDARLGAHLIGSGDLTLPAERERQGGRVIAADGEFVEDRPTLPPNLPWNLDGFLELWHDGRFRSVDRVTNATVSAEGRSSAHEFTNWVAFAALAALGPEWEANGRYYRPIPEWIAGFMLSARTEPLAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA

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

PLDDT	72.3
NLMSIM	80.0
AACOMP	83.1
Seqdif (SeqID)	39.9 (HBN0393353.1)
Structdif (F-Target)	19.4 (1bou D)

ProtNLM

Name	Score
1.13.11.16	0.367
3-carboxyethylcatechol 2,3-dioxygenase	0.288
2,3-dihydroxyphenylpropionate 1,2-dioxygenase	0.107
LigB domain-containing protein	0.044
2,3-dihydroxyphenylpropionate/2, 3-dihydroxicinnamic acid 1,2-dioxygenase	0.024
2,3-dihydroxyphenylpropionate/2,3-dihydroxicinnamic acid 1,2-dioxygenase	0.024