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Target
Aminodeoxyfutalosine synthase
Ligand
BDBM50526602
Substrate
n/a
Meas. Tech.
ChEMBL_1900272 (CHEMBL4402387)
IC50
839000±n/a nM
Citation
 Joshi, S; Fedoseyenko, D; Mahanta, N; Ducati, RG; Feng, M; Schramm, VL; Begley, TP Antibacterial Strategy against  ACS Med Chem Lett 10:363-366 (2019) [PubMed]  Article 
Target
Name:
Aminodeoxyfutalosine synthase
Synonyms:
2.5.1.120 | AFL synthase | Aminodeoxyfutalosine synthase | Aminofutalosine synthase | MQNE_THET8 | Menaquinone biosynthetic enzyme MqnE | mqnE
Type:
PROTEIN
Mol. Mass.:
42621.64
Organism:
Thermus thermophilus (strain HB8 / ATCC 27634 / DSM 579)
Description:
ChEMBL_119077
Residue:
372
Sequence:
MRGIRDPRLIPIAEKVMEGKRLSFEDGLVLYQTKDLPTLMRLANLVRERKHGHKTYFVHSIRVSQTNICYVGCTFCAFQRRFGEEGAWDWDVDEVVAWVKERYQPGLTEIHLTAGHHPKRPFAYYLDLVRALKENFPGVQVKAWTAAEIHHFSKIARLPYREVLKALKEAGLDAMPGGGAEIFAERVRRKIARAKVSAEGWLEIHRTAHELGIPTNATMLYGHIETLEERLDHMDRLRRLQDETGGFMSFIPLAFQPDGNQLARELGKKEFTTGLDDLRNLAVARLYLDNFPHIKGYWATLTPELAQVSLDWGVTDVDGTLIEERIVHMAGSPTPQGLTKRELARIILMAGRIPVERDALYREVRVWDRVEA
  
Inhibitor
Name:
BDBM50526602
Synonyms:
CHEMBL4534412
Type:
Small organic molecule
Emp. Form.:
C21H23N5O7
Mol. Mass.:
457.4366
SMILES:
Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CCC(Cc2cccc(c2)C(O)=O)C(O)=O)[C@@H](O)[C@H]1O |r|
Structure:
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