Compile Data Set for Download or QSAR
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Report error Found 18 Enz. Inhib. hit(s) with all data for entry = 8017
TargetBeta-galactosidase [24-677,R201C](Human)
The University of Tokyo

LigandPNGBDBM228800(NOEV | Sapienic acid (SpA))
Affinity DataKi:  940nM ΔG°:  -35.8kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677](Human)
The University of Tokyo

LigandPNGBDBM228800(NOEV | Sapienic acid (SpA))
Affinity DataKi:  1.10E+3nM ΔG°:  -35.4kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677,I51T](Human)
The University of Tokyo

LigandPNGBDBM228800(NOEV | Sapienic acid (SpA))
Affinity DataKi:  1.20E+3nM ΔG°:  -35.2kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677,I51T](Human)
The University of Tokyo

LigandPNGBDBM50163440((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...)
Affinity DataKi:  4.47E+4nM ΔG°:  -25.8kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetBeta-galactosidase [24-677,R201C](Human)
The University of Tokyo

LigandPNGBDBM50163440((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...)
Affinity DataKi:  4.90E+4nM ΔG°:  -25.6kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetBeta-galactosidase [24-677,R201C](Human)
The University of Tokyo

LigandPNGBDBM228802(5N,6S-(N'-butyliminomethylidene)-6-thio-1-deox...)
Affinity DataKi:  5.33E+4nM ΔG°:  -25.4kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetBeta-galactosidase [24-677](Human)
The University of Tokyo

LigandPNGBDBM50163440((2R,3S,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-tr...)
Affinity DataKi:  6.18E+4nM ΔG°:  -25.0kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetBeta-galactosidase [24-677](Human)
The University of Tokyo

LigandPNGBDBM228802(5N,6S-(N'-butyliminomethylidene)-6-thio-1-deox...)
Affinity DataKi:  6.83E+4nM ΔG°:  -24.7kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetBeta-galactosidase [24-677,I51T](Human)
The University of Tokyo

LigandPNGBDBM228802(5N,6S-(N'-butyliminomethylidene)-6-thio-1-deox...)
Affinity DataKi:  6.88E+4nM ΔG°:  -24.7kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In DepthDetails ArticlePubMedPDB3D3D Structure (crystal)

TargetBeta-galactosidase [24-677](Human)
The University of Tokyo

LigandPNGBDBM228803(5N,6S-(N'-butyliminomethylidene)-6-thiogalacto...)
Affinity DataKi:  2.53E+5nM ΔG°:  -21.4kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677,I51T](Human)
The University of Tokyo

LigandPNGBDBM228803(5N,6S-(N'-butyliminomethylidene)-6-thiogalacto...)
Affinity DataKi:  3.20E+5nM ΔG°:  -20.8kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677,R201C](Human)
The University of Tokyo

LigandPNGBDBM228803(5N,6S-(N'-butyliminomethylidene)-6-thiogalacto...)
Affinity DataKi:  3.20E+5nM ΔG°:  -20.7kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677,I51T](Human)
The University of Tokyo

LigandPNGBDBM228804(N-(N'-butylthiocarbamoyl)-1-deoxygalactonojiri...)
Affinity DataKi:  3.29E+5nM ΔG°:  -20.7kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677](Human)
The University of Tokyo

LigandPNGBDBM228804(N-(N'-butylthiocarbamoyl)-1-deoxygalactonojiri...)
Affinity DataKi:  3.73E+5nM ΔG°:  -20.4kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677,R201C](Human)
The University of Tokyo

LigandPNGBDBM228804(N-(N'-butylthiocarbamoyl)-1-deoxygalactonojiri...)
Affinity DataKi:  3.88E+5nM ΔG°:  -20.3kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677](Human)
The University of Tokyo

LigandPNGBDBM228805(Galactose)
Affinity DataKi:  4.14E+6nM ΔG°:  -14.1kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677,I51T](Human)
The University of Tokyo

LigandPNGBDBM228805(Galactose)
Affinity DataKi:  4.91E+6nM ΔG°:  -13.7kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetBeta-galactosidase [24-677,R201C](Human)
The University of Tokyo

LigandPNGBDBM228805(Galactose)
Affinity DataKi:  5.61E+6nM ΔG°:  -13.4kJ/molepH: 4.5 T: 37°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed