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Target
Mycocyclosin synthase
Ligand
BDBM25817
Substrate
n/a
Meas. Tech.
ChEMBL_721243 (CHEMBL1675120)
Kd
6000±n/a nM
Citation
 Warrilow, AG; Jackson, CJ; Parker, JE; Marczylo, TH; Kelly, DE; Lamb, DC; Kelly, SL Identification, characterization, and azole-binding properties of Mycobacterium smegmatis CYP164A2, a homolog of ML2088, the sole cytochrome P450 gene of Mycobacterium leprae. Antimicrob Agents Chemother 53:1157-64 (2009) [PubMed]  Article 
Target
Name:
Mycocyclosin synthase
Synonyms:
CP121_MYCTU | Cytochrome P450 121 | Cytochrome P450 MT2 | cyp121
Type:
PROTEIN
Mol. Mass.:
43255.98
Organism:
Mycobacterium tuberculosis
Description:
ChEMBL_721243
Residue:
396
Sequence:
MTATVLLEVPFSARGDRIPDAVAELRTREPIRKVRTITGAEAWLVSSYALCTQVLEDRRFSMKETAAAGAPRLNALTVPPEVVNNMGNIADAGLRKAVMKAITPKAPGLEQFLRDTANSLLDNLITEGAPADLRNDFADPLATALHCKVLGIPQEDGPKLFRSLSIAFMSSADPIPAAKINWDRDIEYMAGILENPNITTGLMGELSRLRKDPAYSHVSDELFATIGVTFFGAGVISTGSFLTTALISLIQRPQLRNLLHEKPELIPAGVEELLRINLSFADGLPRLATADIQVGDVLVRKGELVLVLLEGANFDPEHFPNPGSIELDRPNPTSHLAFGRGQHFCPGSALGRRHAQIGIEALLKKMPGVDLAVPIDQLVWRTRFQRRIPERLPVLW
  
Inhibitor
Name:
BDBM25817
Synonyms:
2-(2,4-difluorophenyl)-1,3-bis(1H-1,2,4-triazol-1-yl)propan-2-ol | CHEMBL106 | Diflucan | Fluconazole | Fluconazole (f) | Fungata | Triflucan | US10221160, Fluconazole | US11247981, Example Fluconazole | US9138393, Fluconazole | US9144538, Fluconazole | US9221791, Fluconazole | US9556143, Fluconazole | cid_3365
Type:
Small organic molecule
Emp. Form.:
C13H12F2N6O
Mol. Mass.:
306.2708
SMILES:
OC(Cn1cncn1)(Cn1cncn1)c1ccc(F)cc1F
Structure:
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