Reaction Details
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Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase
Ligand
BDBM81055
Substrate
n/a
Meas. Tech.
Dose Response confirmation of uHTS small molecule inhibitors of Plasmodium falciparum Glucose-6-phosphate dehydrogenase via a fluorescence intensity assay
IC50
1020±n/a nM
Citation
PubChem, PC Dose Response confirmation of uHTS small molecule inhibitors of Plasmodium falciparum Glucose-6-phosphate dehydrogenase via a fluorescence intensity assay PubChem Bioassay (2011)[AID] More Info.:
Target
Name:
Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase
Synonyms:
n/a
Type:
Enzyme Catalytic Domain
Mol. Mass.:
109731.64
Organism:
Plasmodium falciparum 3D7
Description:
gi_12381848
Residue:
950
Sequence:
MEYETSLKCLDEIRCVNNVKYMETEDLTDFNKKSAYYICKEIYEKQLSNENGYVVIGLSGGKTPIDVYKNMCAIKDIKIDKNKLIFFIIDERYKNDDHKFSNYNNIKFLFDELNINKETQLYKPDTKKDLVSCIRDYNEQIKSMIEKYKKIDIVILGMGSDFHIASLFPNVYYNIYMNNYQNNYIYEDNETIRSLNADNNVNLSLLNEQVYFTTTNNFDVRKRITVSLNLLSNSTSKIFLLNTADKLNLWKNMLLNFYVNPNYNLYPAFKMIDSSNTTVIACGHKNYSKMLEDLYVQKDEALSPISNNNVENKNELLTIVIFGCSGDLAKKKIYPALFKLFCNNLLPKNIIIIGFARTGQDFESFFNKIAIYLKISLNSYKNLSVFEKAERLNSFKSKCRYFIGNYLSPESFENFDVYITQEERIALGCCGQKGNEKHKQVNVTSQFPNNHTSINIINNIDNGCESPMLTDSPKRYPCSSSYSSTSGTAVCPYSSQHDVKPSNNGCPYLSSQANTSDSSGCPYISYHTNKSGHLGCPYTITRMLYLALPPHVFVSTLQNYKKYCLNKNRINKILLEKPFGKDLESFKILSKQILETFPEKNIYRIDHYLGKDMVSGLLKLKFTNIFLLSLMNRHFIKCIKITLKETKGVYGRGQYFDPYGIIRDVMQNHMLQLLALITMEHPTDLNDKSIQNEKIKILKSIASIKLEDTVIGQYVKSNNDDTNNNINSNISENASIDKSKINHSYHDDPHVDPNSITPTFCACVLYINSINWHGVPIILKAGKGLNNDICEIKIQFHNIMGSSDESMYNNEFVIILQPVEGIYLKLMIKKMGSEEMEEVQLNLSLNENNNKAYVPEAYETLLSECYKGYKRKFISDEELYESWRIFTPLLNELQEKHIKPLSYPFGSSGPQEAYDLVRKYYNYGKNYATTAKFCRKSSYYDDSLFDNMRE
Inhibitor
Name:
BDBM81055
Synonyms:
2-amino-5-{5-nitro-2H-tetraazol-2-yl}-6-methyl-4-pyridin-3-yl-4H-pyran-3-carbonitrile | 2-amino-6-methyl-5-(5-nitro-2-tetrazolyl)-4-(3-pyridinyl)-4H-pyran-3-carbonitrile | 2-amino-6-methyl-5-(5-nitrotetrazol-2-yl)-4-(3-pyridyl)-4H-pyran-3-carbonitrile | 2-amino-6-methyl-5-(5-nitrotetrazol-2-yl)-4-pyridin-3-yl-4H-pyran-3-carbonitrile | 2-azanyl-6-methyl-5-(5-nitro-1,2,3,4-tetrazol-2-yl)-4-pyridin-3-yl-4H-pyran-3-carbonitrile | MLS000702162 | SMR000225730 | cid_5183241
Type:
Small organic molecule
Emp. Form.:
C13H10N8O3
Mol. Mass.:
326.2703
SMILES:
CC1=C(C([C-](C#N)C(=[NH2+])O1)c1cccnc1)n1nnc(n1)[N+]([O-])=O |t:1|
Structure:
