MVDGE

Prompt

6.2.1.19

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

AI Generated Sequence

499 AAs
MTTLAELLRARAAGLGRPGLYFGDRQVTWHEVAEAGAAAAAALLAAAGVGPGRVGVLDGNTEPGLLALLAAAALAGVLPKLNITTRGAALAACDIAVADAQALLADAALAGLLAGAGLDAVVLDTDSAAYAALAAAAPGALAPRAAVAADLFMMQLFTSGTSGPKPAVRLSHGLLAPGFLTLTERFGLAPDDVVYLSLPLFHANAVLLAWGVALAGGAALALARFSASGFLADVRRHGATYANYVGKPLAYILATPERPDDADNPLRAMGGAEVAPADVAAFAARFGCAVVDGFGSTEGGIAVARTPGTPPAGPGPLAPGVAIVDPATGAPCAPARFDAAGAVLGLVNTAGAGSFAGYYGDAAATAARLAGGVFHSGDLVYRDAAGWLYFAGRAADWMRVDGENLAAAPIERILLRHPAVAEVAVYAVPDPAVGDQVMAALVLAPGAAFGPAAFAAFLAAQPDLGPKRWPAYVRVAAALPRTATFKVLKRALRAAGAAC

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

PLDDT84.3
NLMSIM85.0
AACOMP80.3
Seqdif (SeqID)37.9 (WP_137987469.1)
Structdif (F-Target)9.7 (1t5d 2)

ProtNLM

NameScore
6.2.1.30.153
Long-chain fatty acid--CoA ligase0.144
Long-chain-fatty-acid--CoA ligase FadD170.120
AMP-binding protein0.095
Acyl-CoA synthetase0.083
Fatty-acyl-CoA synthase0.068
Designed by MP, using an AMD MI250 GPU