MWJ6N

Prompt

6.2.1.37

Ligases. Forming carbon-sulfur bonds. Acid--thiol ligases. 3-hydroxybenzoate--CoA ligase.

AI Generated Sequence

500 AAs
MTINEFLRRNAAAHPDRTALIDDDRRVTYGELDALANRFANALLALGLRRGDRVAVMCENSVEFVVAFLGALRAGAVPVPVNTRLTPAEYAYILADSGARALVTDAALLPKVDAVLADTPELRHVVVADGAADGAAAAAAAAAAPAPVRVASTADDMAFWLYSSGSTGKPKGVMLSHRNLLWAAELYGAPVMGLTPDDVYLSAPLFFHAFGLGNAFAFPLSAGASVLLMERFTPAAVFAAIQRHRPTVFYGVPTMYARLLAHPAAAADAASLRVCSSAGEALPPEVGRRWEATFGCRIIDGIGSTEMLHIFLSNRPGDERKPGTAGKPVPGYEVRIVDEDGNPVPAGEIGELVVRGPSAAEYWGNRPAKTATVFDGEWTRTGDLYVRDADGYLYYAGRSDDMLKVSGINVSPVEVEAVLLTHPAVAEAAVIGVPDPELGETVKAFVVLRDGAALTEAELKAHVKARLAKYKYPREIEFVDELPRNATGKIQRFRLRDRAG

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

PLDDT89.1
NLMSIM60.0
AACOMP89.8
Seqdif (SeqID)41.6 (WP_305317103.1)
Structdif (F-Target)6.2 (4fut A)

ProtNLM

NameScore
Benzoate-CoA ligase family protein0.184
Benzoate-CoA ligase0.147
4-hydroxybenzoate--CoA ligase0.132
6.2.1.250.127
AMP-dependent synthetase0.067
Benzoate--CoA ligase0.036
Designed by MP, using an AMD MI250 GPU