Target
Sterol 14-alpha demethylase cyp51A
Ligand
BDBM31774
Substrate
n/a
Meas. Tech.
ChEMBL_724287 (CHEMBL1677680)
Kd
4790±n/a nM
Citation
 Warrilow, AGMelo, NMartel, CMParker, JENes, WDKelly, SLKelly, DE Expression, purification, and characterization of Aspergillus fumigatus sterol 14-alpha demethylase (CYP51) isoenzymes A and B. Antimicrob Agents Chemother 54:4225-34 (2010) [PubMed]  Article 
Target
Name:
Sterol 14-alpha demethylase cyp51A
Synonyms:
14-alpha sterol demethylase Cyp51A
Type:
PROTEIN
Mol. Mass.:
58079.92
Organism:
Neosartorya fumigata (strain ATCC MYA-4609 / Af293 / CBS 101355 / FGSCA1100) (Aspergillus fumigatus)
Description:
ChEMBL_724287
Residue:
515
Sequence:
MVPMLWLTAYMAVAVLTAILLNVVYQLFFRLWNRTEPPMVFHWVPYLGSTISYGIDPYKFFFACREKYGDIFTFILLGQKTTVYLGVQGNEFILNGKLKDVNAEEVYSPLTTPVFGSDVVYDCPNSKLMEQKKFIKYGLTQSALESHVPLIEKEVLDYLRDSPNFQGSSGRVDISAAMAEITIFTAARALQGQEVRSKLTAEFADLYHDLDKGFTPINFMLPWAPLPHNKKRDAAHARMRSIYVDIITQRRLDGEKDSQKSDMIWNLMNCTYKNGQQVPDKEIAHMMITLLMAGQHSSSSISAWIMLRLASQPKVLEELYQEQLANLGPAGPDGSLPPLQYKDLDKLPFHQHVIRETLRIHSSIHSIMRKVKSPLPVPGTPYMIPPGRVLLASPGVTALSDEHFPNAGCWDPHRWENQATKEQENDKVVDYGYGAVSKGTSSPYLPFGAGRHRCIGEKFAYVNLGVILATIVRHLRLFNVDGKKGVPETDYSSLFSGPMKPSIIGWEKRSKNTSK
  
Inhibitor
Name:
BDBM31774
Synonyms:
CHEMBL104 | Canesten | Clotrimazole | Lotrimin | Mycelex | US9138393, Clotrimazole | cid_2812
Type:
Small organic molecule
Emp. Form.:
C22H17ClN2
Mol. Mass.:
344.837
SMILES:
Clc1ccccc1C(c1ccccc1)(c1ccccc1)n1ccnc1
Structure:
Search PDB for entries with ligand similarity: