M3UDJ

Prompt

6.2.1.6

Ligases. Forming carbon-sulfur bonds. Acid--thiol ligases. glutarate--CoA ligase.

AI Generated Sequence

499 AAs
MSDLLDRRLAALADDPAALRGLRRGIERECLRVTPDGRLAQTPHPAALGSALTHPQITTDYSESLLEFITPAHPDIAACLAFLDDIHRFVYRRLGDELLWPNSMPCFLDDDDAIPLAQYGSSNIGRMKTVYREGLARRYGRLMQTIAGVHYNFSFPDAFWPALADDDAAAARDFRSGAYFGLIRNFRRHGWLLLYLFGASPALCAGFLRGRPHALEPFDAGTLYLPHATSLRMGDLGYQNAAQAGLTICYNDLAGYLDTLRRAVTTPYPAFAAIGTHRDGEWRQLNTNVLQIENEYYSTIRPKRVTRSGERPIQALAERGVEYVEVRCLDINPFAPVGIAEPEARFLDAFLLFCAFDDSPPLDGDECAATRANFNRVVWEGRRPGLTLRDGREAVALKDWGAELFADIAPIARLMDAAHGGDAHAAAVAAQRAKVADPALPTSARVLAAMRAHGEGFGAFALRQSEAHAEAFRAEPLDAATRAAFDARARASLAAQAAE

Ligand/Cofactor

ATP

C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N

Validation Metrics

PLDDT93.3
NLMSIM70.0
AACOMP88.4
Seqdif (SeqID)32.5 (WP_225786644.1)
Structdif (F-Target)5.1 (1va6 A)

ProtNLM

NameScore
Gamma-glutamylcysteine synthetase0.241
Gamma-ECS0.215
GCS0.210
6.3.2.20.188
Glutamate--cysteine ligase0.140
Ergothioneine biosynthesis glutamate--cysteine ligase EgtA0.000
Designed by MP, using an AMD MI250 GPU