M8TNX

Prompt

3.1.2.2

Hydrolases. Acting on ester bonds. Thiolester hydrolases. palmitoyl-CoA hydrolase.

AI Generated Sequence

168 AAs
MTEKPASESEVIMTELVMPADTNALGNVFGGELLAKLDLAAAISARRHSRRYVVTASVNQVAFKHAIHLGSVVTTEAKVNRAFTSSMEIGIKVIAEDIRSGTRRKATSSYFTMVAVDDDGRPVPVPALEPETELEIRRYAGALRRRQLRLALEGKMKPADAVELKALF

Ligand/Cofactor

palmitoyl-CoA

CCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)C(C(C)(C)COP(=O)(O)OP(=O)(O)OCC1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O

Validation Metrics

PLDDT89.6
NLMSIM80.0
AACOMP92.2
Seqdif (SeqID)33.9 (WP_210666974.1)
Structdif (F-Target)3.9 (2qq2 H)

ProtNLM

NameScore
Acyl-CoA thioesterase0.635
Acyl-CoA hydrolase0.210
Acyl-CoA thioester hydrolase0.036
3.1.2.-0.025
Thioesterase superfamily protein0.021
HotDog ACOT-type domain-containing protein0.015
Designed by MP, using an AMD MI250 GPU