MIJXW

Prompt

3.1.2.1

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

AI Generated Sequence

499 AAs
MSTLLDRIRSNPSLKKVVTPAEAAALIKPGMTVGMSGFTGTGYPKPVPLALADRAKNGQLKINLFVGASLGPELDKMWAEADLINRRMPFQVSDTMRKGINAGEVMFVDQHLSHVPDLLRNGQLKPLDVAIIEAVAITEDGLIVPTSSVGNKPSFLELADKVIIEVNMAQPLSFEGLHDIYIETQAPHRTPLPITKPDERIGTIAIPIDPEKVAGIVETNFPDSPSGTVEPDEISNAIANHLIEFFKHEVKRGRLPNKLLPLQSGINKTANAVLTGLLDSPFENLEVYSEVLQDSVFDLFDAGKLDFASGTSIRLSPEGMKRVFGNFEKYKDKLVLRPQEISNHPEVIRRLGCIAMNTPLEIDIYGNVNSTHVMGTRMMNGIGGSGDFARNARLSIFVTKSTAKDGKISSIVPFVTHVDHTEHDVDVIVTEQGLADLRGLSPKERARVIIENCAHPMYRPMLQDYFDRALKHGGHTPHILEKAFSMHTNYEETGTMKLE

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

PLDDT84.6
NLMSIM80.0
AACOMP95.0
Seqdif (SeqID)34.3 (WP_270584431.1)
Structdif (F-Target)2.6 (2g39 B)

ProtNLM

NameScore
Acetyl-CoA hydrolase0.342
Acetyl-CoA hydrolase/transferase family protein0.203
Succinyl-CoA:acetate CoA-transferase0.196
Succinyl-CoA:coenzyme A transferase0.050
2.8.3.-0.050
Propionyl-CoA--succinate CoA transferase0.044
Designed by MP, using an AMD MI250 GPU