MR2I2

Prompt

3.1.2.1

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

AI Generated Sequence

500 AAs
MRVRFPAFLDKLVTAEEAAALIPHGMTVGWSGFTGAGYPKLVPTALADHVAANGQLKINLVTGASLGAEADGRLAEADAIERRAPFQVGKEIARGINAGEARYFDIHLSHVPQDLRYGFLGRLDVAVVEATAITEDGSLVLGTSVGVTPTWLEQADKVIIEVNTAQPVSFEGLHDIDMADIPPHRRTPLPIVPVDRIGTPYIPIDPAKVVAIVESDAPDTGPGPNPNDAVSEAIAGHLIDFLTHEVKRGRMPENLLPLQSGIGKIANAVLEGLAKSGFENLTVWTEVIQDSFLDLFDSGKLTYASATSIRLSPEGFKRFYDNMDGYQSKLCLRPQEISNSPELIRRLGVIAMNTPLEVDIYGNANSTHVMGSRMMNGLGGSGDFLRNAKYSIMVTPSVAKDGKISHIVPMATHVDHTEHDLDVIVTEQGLADLRGLSPRERARVIIDKCAHPDYKPILQDYLDRALACKGHTPHLLKDALSMHRNLEETGTMKRTAWAAA

Ligand/Cofactor

acetyl-CoA

CC(=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

PLDDT84.3
NLMSIM90.0
AACOMP95.9
Seqdif (SeqID)34.8 (XP_013330445.1)
Structdif (F-Target)2.3 (2g39 B)

ProtNLM

NameScore
Acetyl-CoA hydrolase0.420
Acetyl-CoA hydrolase/transferase family protein0.258
Succinyl-CoA:acetate CoA-transferase0.123
Propionyl-CoA--succinate CoA transferase0.057
3.1.2.10.028
Succinate CoA transferase0.024
Designed by MP, using an AMD MI250 GPU