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InhA in complex with a DNA encoded library hit
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创建时间：
2024-01-10
相关数据集
Complete analysis of data from screening for antitubercular activity and physico chemical properties of the hit compounds.
Rifampicin and Isoniazid were taken as controls. MIC values for controls against M. smegmatis are Rif-2.43±0.02μM and Inh-11.03±0.05 μM and H37Rv are Rif-0.08±0.01μM and Inh-0.22±0.3 μM.
NIAID Data Ecosystem60
Supplementary material. Discovery of novel and potent InhA inhibitors by an in silico screening and pharmacokinetic prediction
Figure S1. RMSD plots of template molecule (a), AG-690/13705356 (b), AG-690/14006355 (c), AP-845/40876827 (d), AE-848/34504008 (e), AP-845/40876825 (f), AP-845/40876828 (g), AP-845/4087683
NIAID Data Ecosystem30
Data_Sheet_3_Screening of Compounds for Anti-tuberculosis Activity, and in vitro and in vivo Evaluation of Potential Candidates.xls
Tuberculosis (TB) is a debilitating infectious disease responsible for more than one million deaths per year. The emergence of drug-resistant TB poses an urgent need for the development of new anti-TB
NIAID Data Ecosystem30
EthR ligand complex
EthR ligand complex Descriptor: 2-[2-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2,3-triazol-1-yl]ethyl]-6-methyl-1~{H}-pyrimidin-4-one, HTH-type transcriptional regulator EthR Authors: Pohl, E, Tatum, N.
Protein Data Bank Japan2024-01-24 更新30
