MXSVR

Prompt

6.2.1.1

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

AI Generated Sequence

645 AAs
MSEKLYPVPEEVAKNALIDNETYQKMYEESVKNPDGFWAEQGKRIDWIKPFTKVKNTSFDKGVDIKWYEDGLTNVSYNCIDRHLKTRGDQVAIIWEGDNPSDDKKITYRELHEQVCRMANVLKKNGVKKGDRVTIYMPMIPEAAYAMLACARIGAVHSIVFGGFSPDSLAGRIVDCDSKVVITADEGLRGGRKIPLKENVDKALDICPNSVKTVLVVKRTGNKVTMVEGRDVWYHEEAAQVSDYCPPEPMNAEDPLFILYTSGSTGKPKGVLHTTGGYLVYASMTFKYVFDYHEGDVYWCTADVGWVTGHSYIVYGPLANGATTLMFEGVPNYPTASRFWQVVDKHKVNIFYTAPTAIRALMGKGDEPVKKTSRKSLRILGSVGEPINPEAWEWYYNVVGESRCPIVDTWWQTETGGIMITPLPGATDLKPGSATKPFFGVQPVLVDEEGNEIEGEASGNLVIKDSWPGQMRTVYGDHERFIQTYFSTYPGKYFTGDGCRRDEDGYYWITGRVDDVLNVSGHRMGTAEVESALVAHDKVAEAAVVGYPHDIKGQGIYAYVTLMAGEEPTDELRKELVAWVRKEIGPIATPDLIQFAPGLPKTRSGKIMRRILRKIAENEYDSLGDTSTLADPAVVDDLIENRMNR

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

PLDDT87.7
NLMSIM70.0
AACOMP92.5
Seqdif (SeqID)16.4 (MBX3571895.1)
Structdif (F-Target)3.1 (8g0t B)

ProtNLM

NameScore
Acs0.296
6.2.1.10.169
Acetyl-coenzyme A synthetase0.157
Acetate--CoA ligase0.145
AcCoA synthetase0.116
Acyl-activating enzyme0.111
Designed by MP, using an AMD MI250 GPU