MXHIA

Prompt

6.3.2.4

Ligases. Forming carbon-nitrogen bonds. Acid--amino-acid ligases.(peptide synthases). D-alanine--D-alanine ligase.

AI Generated Sequence

301 AAs
MKKIAVLMGGWSSEREVSLKSGKACAEALDEKGYRVTRIDVTRDIGERLKELKPDVVFNALHGPFGEDGTIQGVLELMKIPYTHSGVLASALAMDKQRAKQVFAAAGLPVAEGVVMNRFEVLKSHPMPYPVVKPVREGSSFGVSYVVEEQKQLPPPIELAWESHGDEVLVEPFVAGRELTVGVMGDVALPVTEIVPTKHWYDYDAKYTEGGSKHVIPAEIPEKIYELIQQYAKKAHTALGCRGVSRSDFRWDDDGNLILLEVNTQPGMTPTSLVPESAAHCGMSFGELVSWMVEDASLERN

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
NLMSIM90.0
AACOMP93.0
Seqdif (SeqID)31.8 (WP_111160486.1)
Structdif (F-Target)6.2 (4c5b A)

ProtNLM

NameScore
D-alanylalanine synthetase0.293
D-alanine--D-alanine ligase0.247
D-Ala-D-Ala ligase0.233
6.3.2.40.222
D-alanine--D-alanine ligase B0.001
D-alanine--D-alanine ligase A0.000
Designed by MP, using an AMD MI250 GPU