MH28Z

Prompt

6.2.1.17

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

AI Generated Sequence

623 AAs
MARYRETFHRSIDDPEAFWAEQARRIHWDKPFDRVLDYSRPPFARWFVGGRTNLCYNAVDRHLAARGDQVALIAVSSTEGTERRFTFAELHDEVNRVAAMLRELGVRKGDRVIIYMPMIAEAVFAMLACARIGAIHSVVFGGFAANSLATRIDDAKPAKVVSADCGARGGKVIEYKPLLDEAIKMATHKPPRVLIVDRGLARLAWNEGRDVDWEALRARVGAQVPCVWLESDEPLYILHYSGTTGKPKGVQRDVGGYAVALATSMKYIFDGEPGDVFFTASDIGWVVGHSYIVYGPLLAGMTTVLYEGTPVRPDAGIWWRIVEKYRVATMFTAPTAIRVLKKFDPATLAEKYDLSSLKFAFLAGEPLDEPTAHWVTETLGVPVIDNYWQTETGWPIMAVPLGLEETPLKPGSPGKPVYGYDVRLLDEATGEECPAGEKGIIAVELPMPPGCMTTIWKDDERFVTTYWSQFPKGVYLTGFDWGIRDEGYFYIMGRTDDVINVAGHRLGTREIEEAISAHPSVAECAVVGVADELKGQVPLAFVVLKDGVEVTEELVAELVQRVDSEIGPVAKPAQVHFVGALPKTRSGKILRRTMRAIAEGRDPGDLSTIEDPAVLDEIRAALR

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

PLDDT85.5
NLMSIM85.0
AACOMP93.3
Seqdif (SeqID)32.2 (WP_253927536.1)
Structdif (F-Target)5.3 (1ry2 A)

ProtNLM

NameScore
Propionate--CoA ligase0.409
6.2.1.170.282
Propionyl-CoA synthetase0.204
Acetyl-coenzyme A synthetase0.035
6.2.1.10.017
Acetate--CoA ligase0.009
Designed by MP, using an AMD MI250 GPU