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Target
2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase
Ligand
BDBM31916
Substrate
n/a
Meas. Tech.
ChEMBL_2102082 (CHEMBL4810478)
Kd
22000±n/a nM
Citation
 Blain, JM; Grote, DL; Watkins, SM; Goshu, GM; Muller, C; Gorman, JL; Ranieri, G; Walter, RL; Hofstetter, H; Horn, JR; Hagen, TJ Structural and biophysical characterization of the Burkholderia pseudomallei IspF inhibitor L-tryptophan hydroxamate. Bioorg Med Chem Lett 48:0 (2021) [PubMed]  Article 
Target
Name:
2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase
Synonyms:
2C-methyl-D-erythritol-2,4-cyclodiphosphate synthase (IspF) | ISPF_ECOLI | MECDP-synthase | MECPS | ispF | mecS | ygbB
Type:
Homotrimer
Mol. Mass.:
16897.34
Organism:
Escherichia coli (strain K12)
Description:
P62617
Residue:
159
Sequence:
MRIGHGFDVHAFGGEGPIIIGGVRIPYEKGLLAHSDGDVALHALTDALLGAAALGDIGKLFPDTDPAFKGADSRELLREAWRRIQAKGYTLGNVDVTIIAQAPKMLPHIPQMRVFIAEDLGCHMDDVNVKATTTEKLGFTGRGEGIACEAVALLIKATK
  
Inhibitor
Name:
BDBM31916
Synonyms:
Tryptophanhydroxamate, 13
Type:
Small organic molecule
Emp. Form.:
C11H13N3O2
Mol. Mass.:
219.2398
SMILES:
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NO |r|
Structure:
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