MSASF

Prompt

6.2.1.75

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

AI Generated Sequence

644 AAs
MSEKLFDVPAEIAKNALIDEATYQKMYAESVKDPDGFWGEQAKRIDWIKPFTKVKNTSFDGDVKIKWFEDGTLNVSYNCVDRHLKTRGDQTAIIWEGDNPTDSKKITYRELHERVCRMANVLKKRGVKKGDRVCIYMPMIAEAAYAMLACARIGAVHSVVFGGFSPDSLAGRILDCESKLVITCDEGLRGGKLIPLKANVDKALDITGDVSTVMVVKRTGADVPWVEGRDVWYHEETAQVSDYCPAEPMDAEDPLFILYTSGSTGKPKGVVHTTGGYLVYASMTFKYVFDYHEGDVYWCTADVGWVTGHSYIVYGPLANGATTLMFEGVPNYPDAGRCWQVVDKHNVNIFYTAPTAIRALMGEGDEPVTKTSRSSLRILGSVGEPINPEAWNWYYNVVGEGRCPIVDTWWQTETGGIMLTPLPGATPLKPGSATRPFFGVQPVLMDEEGKELEGEATGNLVIKASWPGIMRTVYGDHERFIETYFSTYPGMYFTGDGCRRDEDGYYWITGRVDDVINVSGHRMGTAEVESALVAHDKVAEAAVVGYPHDIKGQGIYAYVTLMEGVEPTEELRKELVAHVRKEIGPIATPDLIQFAPGLPKTRSGKIMRRILRKIAENELDNLGDTSTLADPSVVDDLIENRMNR

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

PLDDT87.5
NLMSIM60.0
AACOMP92.9
Seqdif (SeqID)19.7 (WP_206943819.1)
Structdif (F-Target)2.8 (8g0v C)

ProtNLM

NameScore
Acs0.291
6.2.1.10.171
Acetyl-coenzyme A synthetase0.158
Acetate--CoA ligase0.150
AcCoA synthetase0.114
Acyl-activating enzyme0.111
Designed by MP, using an AMD MI250 GPU