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Target
Acyl-protein thioesterase 2 [S122A]
Ligand
BDBM207993
Substrate
n/a
Meas. Tech.
Fluorescence Binding Assays
Temperature
298.15±n/a K
Kd
770±0.0 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 [S122A]
Synonyms:
APT2 | Acyl-protein thioesterase 2 (APT2 S122A) | LYPA2_HUMAN | LYPLA2
Type:
Protein
Mol. Mass.:
24724.23
Organism:
Homo sapiens (Human)
Description:
Human APT2 with S122A mutation
Residue:
231
Sequence:
MCGNTMSVPLLTDAATVSGAERETAAVIFLHGLGDTGHSWADALSTIRLPHVKYICPHAPRIPVTLNMKMVMPSWFDLMGLSPDAPEDEAGIKKAAENIKALIEHEMKNGIPANRIVLGGFAQGGALSLYTALTCPHPLAGIVALSCWLPLHRAFPQAANGSAKDLAILQCHGELDPMVPVRFGALTAEKLRSVVTPARVQFKTYPGVMHSSCPQEMAAVKEFLEKLLPPV
  
Inhibitor
Name:
BDBM207993
Synonyms:
ML349-FL
Type:
Small organic molecule
Emp. Form.:
C54H52N6O13S2
Mol. Mass.:
1057.153
SMILES:
OC(=O)c1ccc(cc1C1C2C=CC(=O)C=C2Oc2cc(O)ccc12)C(=O)NCCOCCOCCOCCn1cc(COc2ccc(cc2)N2CCN(CC2)C(=O)c2cc3CS(=O)(=O)c4ccccc4-c3s2)nn1 |c:12,16|
Structure:
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