M8633

Prompt

6.2.1.3

Ligases. Forming carbon-sulfur bonds. Acid--thiol ligases. long-chain-fatty-acid--CoA ligase.

AI Generated Sequence

499 AAs
MTTVAELLAERAADTDRGILYEGDRWTTWRQVHESVARAAALLAELGAGRPVHVGVLLDNTPEFLALWLGAALGGVVPVGLNTLRRGAELAHDIAHADCQLILTDEALAPLLAGLDLGAVRLDTSDAAWAALVAGAPDLAPHRAVAPDDAMLLIFTSGTSGEPKGVRCSHGKMARFGVMLAERFGLTPGDVCYCSMPLFHGNAVVVGWAVALAAGASLALRRFSASGFLDDVRRYGATFYNYVGKPLSYILATPERPDDADNPLRVAFGTEAAPRDHAEFTRRFGCEVLDGFGSTEGGVAIFRNPDTPKGSLGRPLPGVAIYDPATGAEPPAARLDAAGVVANPDGAVGELVNTRGPGRFEGYYKNPAATAERMRHGWYHSGDLAYRDADGWLYFAGRTGDWIRVDGENLGAAPIERILNRHPDVAEVAVYGVPDPRVGDQVMAAVVLRPGAELDPAAFAAFLAAQPDLGPKQWPRYVRVSRQLPVTGTNKLVKRELRA

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

PLDDT89.8
NLMSIM85.0
AACOMP89.5
Seqdif (SeqID)37.3 (WP_324389407.1)
Structdif (F-Target)12.1 (3cw8 X)

ProtNLM

NameScore
Acyl-CoA synthetase0.421
Fatty-acyl-CoA synthase0.182
AMP-binding protein0.119
6.2.1.30.077
Long-chain-fatty-acid--CoA ligase FadD170.074
Long-chain fatty-acid--CoA ligase FadD170.017
Designed by MP, using an AMD MI250 GPU