Reaction Details Report a problem with these data
Target
Acyl-protein thioesterase 2 [P86Q]
Ligand
BDBM207992
Substrate
n/a
Meas. Tech.
Steady-State Kinetic Assays
pH
6.5±n/a
Ki
130±10 nM
Comments
extracted
Citation
 Won, SJ; Davda, D; Labby, KJ; Hwang, SY; Pricer, R; Majmudar, JD; Armacost, KA; Rodriguez, LA; Rodriguez, CL; Chong, FS; Torossian, KA; Palakurthi, J; Hur, ES; Meagher, JL; Brooks, CL; Stuckey, JA; Martin, BR Molecular Mechanism for Isoform-Selective Inhibition of Acyl Protein Thioesterases 1 and 2 (APT1 and APT2). ACS Chem Biol 11:3374-3382 (2016) [PubMed]  Article 
Target
Name:
Acyl-protein thioesterase 2 [P86Q]
Synonyms:
APT2 | Acyl-protein thioesterase 2 (APT2 P86Q) | LYPA2_HUMAN | LYPLA2
Type:
Protein
Mol. Mass.:
24771.24
Organism:
Homo sapiens (Human)
Description:
Human APT2 with P86Q mutation
Residue:
231
Sequence:
MCGNTMSVPLLTDAATVSGAERETAAVIFLHGLGDTGHSWADALSTIRLPHVKYICPHAPRIPVTLNMKMVMPSWFDLMGLSPDAQEDEAGIKKAAENIKALIEHEMKNGIPANRIVLGGFSQGGALSLYTALTCPHPLAGIVALSCWLPLHRAFPQAANGSAKDLAILQCHGELDPMVPVRFGALTAEKLRSVVTPARVQFKTYPGVMHSSCPQEMAAVKEFLEKLLPPV
  
Inhibitor
Name:
BDBM207992
Synonyms:
ML349
Type:
Small organic molecule
Emp. Form.:
C23H22N2O4S2
Mol. Mass.:
454.562
SMILES:
COc1ccc(cc1)N1CCN(CC1)C(=O)c1cc2CS(=O)(=O)c3ccccc3-c2s1
Structure:
Search PDB for entries with ligand similarity: