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Target
2-C-methyl-D-erythritol 2,4-cyclodiphosphate synthase
Ligand
BDBM50194153
Substrate
n/a
Meas. Tech.
ChEMBL_1332680 (CHEMBL3224262)
IC50
768000±n/a nM
Citation
 Bitok, JK; Meyers, CF Synthesis and evaluation of stable substrate analogs as potential modulators of cyclodiphosphate synthase IspF. Medchemcomm 4:130-134 (2013) [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:
BDBM50194153
Synonyms:
5'-CDP | CDP | CHEMBL425252 | Cytidine | Cytidine 5'-diphosphoric acid | Cytidine 5'-pyrophosphate | Cytidine, 5'-(trihydrogen pyrophosphate) | cytidine 5'-(trihydrogen diphosphate)
Type:
Small organic molecule
Emp. Form.:
C9H15N3O11P2
Mol. Mass.:
403.1764
SMILES:
Nc1ccn([C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)c(=O)n1
Structure:
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