M5ITN

Prompt

1.21.3.1

Oxidoreductases. Catalyzing the reaction X-H + Y-H = 'X-Y'. With oxygen as acceptor. isopenicillin-N synthase.

AI Generated Sequence

298 AAs
MTEIPVIDLSPLLSGDADRARVAAAVRDACREWGFFYVTGHGVDPALLDRVRAAFAAFRAEPDAEKAAIAARDPASRGYVGYGQEALAGKVDRTEAVYNFCPADVPHPSLAAHPLEPNQWPDDLPAFRAFTEAYAADLAALAADLLRLLAEGLGLPERFFADAVADGQSLLKLVNYYPPLAPPAALRLGEHTDLGGITLLFQAQVPGLQVLRPDGGWIDVAPLPGALVVNLGDMLQRLTNGYYRSPLHRVVVSPGRRLSIAFFQNPLNETVVAPLAGAAGDAPPRYADGTYRRLAAAA

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

PLDDT91.6
NLMSIM90.0
AACOMP87.3
Seqdif (SeqID)54.8 (WP_196941881.1)
Structdif (F-Target)10.2 (3oox B)

ProtNLM

NameScore
Isopenicillin N synthase family oxygenase0.248
Isopenicillin N synthase-like dioxygenase0.216
Isopenicillin N synthase0.175
2OG-Fe(II) oxygenase0.084
1.13.12.190.044
Fe2OG dioxygenase domain-containing protein0.041
Designed by MP, using an AMD MI250 GPU