M3XUL

Prompt

1.14.15.12

Oxidoreductases. Acting on paired donors, with incorporation or reduction of molecular oxygen. The oxygen incorporated need not be derived from O2. With reduced iron-sulfur protein as one donor, and incorporation of one atom of oxygen. Transferred entry: 1.14.14.46.

AI Generated Sequence

278 AAs

MSTIKKDREAGMINPAYDCQPAGAQFALIGIKDCIPLVHGGQGCTMFVKLLFAQHFKENFDLASSALHEDGAVWGGANRVEEGVKTVLDRYPTKLLRPIITTCGTEITGDDVGDTLKEIYKPELAKIKTPLCMETHGPDFISFVAGYDAACEALVKEVDEAFGVKRNAPDKPLNLWPGWVRPGDVEKLKHLIAEGIEANLLFDIETFDLTPLPGSVAEHTHGNTTIEDLSRSADALTLNLARFSEGGAAAFLQKEFGVPYVGRFTPWGIKNTDMFLRI

Ligand/Cofactor

FAD

CC1=CC2=C(C=C1C)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O

Validation Metrics

PLDDT	73.5
NLMSIM	60.0
AACOMP	93.7
Seqdif (SeqID)	45.4 (HTH41087.1)
Structdif (F-Target)	12.3 (5n6y E)

ProtNLM

Name	Score
Nitrogenase	0.119
Nitrogenase iron-molybdenum cofactor biosynthesis protein NifN	0.108
Vanadium dinitrogenase beta subunit	0.077
Oxidored_nitro domain-containing protein	0.071
Nitrogenase iron-iron protein beta chain	0.054
Nitrogenase vanadium-cofactor synthesis protein VnfN	0.039