MHN1U

Prompt

6.2.1.37

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

AI Generated Sequence

500 AAs
MTNLIAELLERNARRGDRTAIIWDGERSLTYGELDRQVSRFAGYLQALGLRRGDRVAVLLPNSPEFVIAFLGALRLGAVVPVLNTRLTAAEIGYILNDSEAKAIVTSAAFLPKVEEVVPGTPGLEHIIVAGDELPPGASFRDLLAGADEPLPVRSTSDDDAAWLWYTSGSTGRPKGVMTHRNLYASAEAYAQDWLGLRPEDVLLCAVPKLFYAFGLNGVFAPLVAGATVVLMEPRATPEKVFETIRRHRTTQFYGVPTMYARLLGHPEAPGRDLASLRVCSAGEALPEPVARRWEERWGVRILEGYGSTELLHIFSNAPGEERKPGSVGRVVPGYEVRIVDEEGNEVPAGEVGELYIRGPSVMAGYWNRPEKTAKTFEDGWLRTGDLYRDEDGYFYYTGRSDDMIKVSGVNVSPIEVESVLLTHPDVAECAVIGVPDERWGEQPKAFVVLKPGATLSEEELKRHCRETLAPYKYPREIWFVDELPKTATGKIQRKELRKL

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

PLDDT83.3
NLMSIM60.0
AACOMP93.0
Seqdif (SeqID)48.7 (MBK8064133.1)
Structdif (F-Target)7.6 (4fut A)

ProtNLM

NameScore
AMP-dependent synthetase0.117
AMP-dependent synthetase and ligase0.102
Long-chain-fatty-acid--CoA ligase0.084
AMP-binding protein0.084
6.2.1.250.061
4-hydroxybenzoate--CoA ligase0.053
Designed by MP, using an AMD MI250 GPU