Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Synechocystis sp. (strain PCC 6803)) | BDBM50153713 (3-(N-hydroxyformamido)propylphosphonic acid | 3-[F...) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Oregon State University Curated by ChEMBL | Assay Description Binding affinity against Synechocystis strain PCC6803 DXP reductoisomerase | Bioorg Med Chem Lett 14: 5309-12 (2004) Article DOI: 10.1016/j.bmcl.2004.08.023 BindingDB Entry DOI: 10.7270/Q25T3M75 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50181153 (3-(N-hydroxyacetamido)propylphosphonic acid | 3-(N...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | 130 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50153713 (3-(N-hydroxyformamido)propylphosphonic acid | 3-[F...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | 140 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM59100 (Bi-ligand, 3) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 202 | n/a | n/a | n/a | n/a | n/a | n/a | 7.4 | n/a |
Triad Therapeutics, Inc | Assay Description All reactions were monitored spectrophotometrically at 340 nm by using initial rates from the first 5% of reaction. | Chem Biol 11: 185-94 (2004) Article DOI: 10.1016/j.chembiol.2004.02.012 BindingDB Entry DOI: 10.7270/Q2K9360M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152418 ((1E,1E)-O,O-(Ethane-1,2-diyl)bis[2,4,5...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50181154 (1-(3,4-dichlorophenyl)-3-(N-hydroxyformamido)propy...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid PDB UniChem Similars | PDB Article PubMed | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50181148 (1-(3,4-dichlorophenyl)-3-(N-hydroxyacetamido)propy...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid PDB UniChem Similars | PDB Article PubMed | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50335492 ((pyridin-2-ylmethyl)phosphonic acid | CHEMBL161524...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152420 ((E)-2,4,5-Trihydroxybenzaldehyde oxime (7)) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | KEGG PC cid PC sid UniChem Similars | Article PubMed | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50335493 (5-Phenylpyridin-2-ylmethylphosphonic acid | CHEMBL...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152421 ((E)-2,4,5-Trihydroxybenzaldehyde O-methyl oxime (8...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50335490 (CHEMBL1651840 | Pyridin-4-ylmethylphosphonic acid) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Patents | Article PubMed | 6.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50335494 ((quinolin-2-ylmethyl)phosphonic acid | CHEMBL16152...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL MMDB PC cid PC sid PDB UniChem | Article PubMed | 6.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50347578 (CHEMBL1801648) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 6.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM50044976 (CHEMBL2316879) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 7.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Strasbourg/CNRS Curated by ChEMBL | Assay Description Uncompetitive inhibition of His-tagged Escherichia coli DXR at 1 to 8 uM pre-incubated for 2 mins before reaction initiation in presence of 160 uM NA... | Bioorg Med Chem 22: 3713-9 (2014) Article DOI: 10.1016/j.bmc.2014.05.004 BindingDB Entry DOI: 10.7270/Q2057HKT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM59101 (Bi-ligand, 4) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 7.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | 7.4 | n/a |
Triad Therapeutics, Inc | Assay Description All reactions were monitored spectrophotometrically at 340 nm by using initial rates from the first 5% of reaction. | Chem Biol 11: 185-94 (2004) Article DOI: 10.1016/j.chembiol.2004.02.012 BindingDB Entry DOI: 10.7270/Q2K9360M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152422 ((E)-2,4,5-Trihydroxybenzaldehyde O-benzyl oxime (9...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 9.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM59099 (Bi-ligand, 2) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 7.4 | n/a |
Triad Therapeutics, Inc | Assay Description All reactions were monitored spectrophotometrically at 340 nm by using initial rates from the first 5% of reaction. | Chem Biol 11: 185-94 (2004) Article DOI: 10.1016/j.chembiol.2004.02.012 BindingDB Entry DOI: 10.7270/Q2K9360M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50347582 (CHEMBL1801642) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 1.24E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152434 ((E)-2-Fluoro-4,5-dihydroxybenzaldehyde O-methyl ox...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 1.51E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50347580 (CHEMBL1801651) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 1.73E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152417 (Sodium (1E,7E)-1-(2,4,5-trihydroxyphenyl)-3,6-diox...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 1.84E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50335486 (1-Hydroxy-5-phenylpyridin-2-one | 1-hydroxy-5-phen...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 2.18E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152429 ((E)-3,4,5-Trihydroxybenzaldehyde O-methyl oxime (1...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 2.94E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Synechocystis sp. (strain PCC 6803)) | BDBM50153710 (3S-hydroxypentan-2-one 5-phosphate) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Oregon State University Curated by ChEMBL | Assay Description Binding affinity against Synechocystis strain PCC6803 DXP reductoisomerase | Bioorg Med Chem Lett 14: 5309-12 (2004) Article DOI: 10.1016/j.bmcl.2004.08.023 BindingDB Entry DOI: 10.7270/Q25T3M75 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50135835 ((isoquinolin-1-ylamino)methylenediphosphonic acid ...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | 3.27E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50347577 (CHEMBL1801647) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 3.27E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50347579 (CHEMBL1801650) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 4.52E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152433 ((E)-2-Hydroxy-3-nitrobenzaldehyde O-methyl oxime (...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 4.78E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM59098 (Bi-ligand, 1) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 7.4 | n/a |
Triad Therapeutics, Inc | Assay Description All reactions were monitored spectrophotometrically at 340 nm by using initial rates from the first 5% of reaction. | Chem Biol 11: 185-94 (2004) Article DOI: 10.1016/j.chembiol.2004.02.012 BindingDB Entry DOI: 10.7270/Q2K9360M | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Mycobacterium tuberculosis) | BDBM50347581 (CHEMBL1801655) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 5.07E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Baylor College of Medicine Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc... | J Med Chem 54: 4721-34 (2011) Article DOI: 10.1021/jm200363d BindingDB Entry DOI: 10.7270/Q2NK3FCT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152424 ((E)-5-[(2-Methylhydrazono)methyl]benzene-1,2,4-tri...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | >7.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152423 (5-[(Methoxyamino)methyl]benzene-1,2,4-triol hydroc...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | >7.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152419 (2,4,5-trihydroxybenzaldehyde (6)) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Similars | Article PubMed | >7.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Synechocystis sp. (strain PCC 6803)) | BDBM50153711 (2S,3R-dihydroxybutyramide 4-phosphate) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 9.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Oregon State University Curated by ChEMBL | Assay Description Binding affinity against Synechocystis strain PCC6803 DXP reductoisomerase | Bioorg Med Chem Lett 14: 5309-12 (2004) Article DOI: 10.1016/j.bmcl.2004.08.023 BindingDB Entry DOI: 10.7270/Q25T3M75 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152425 ((E,Z)-2,4,5-Trimethoxybenzaldehyde O-methyl oxime ...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM50153710 (3S-hydroxypentan-2-one 5-phosphate) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 1.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Oregon State University Curated by ChEMBL | Assay Description Inhibitory activity against Escherichia coli deoxyxylulose 5-phosphate reductoisomerase | Bioorg Med Chem Lett 14: 5309-12 (2004) Article DOI: 10.1016/j.bmcl.2004.08.023 BindingDB Entry DOI: 10.7270/Q25T3M75 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Synechocystis sp. (strain PCC 6803)) | BDBM50153714 (4S-hydroxypentan-2-one 5-phosphate) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 1.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Oregon State University Curated by ChEMBL | Assay Description Binding affinity against Synechocystis strain PCC6803 DXP reductoisomerase | Bioorg Med Chem Lett 14: 5309-12 (2004) Article DOI: 10.1016/j.bmcl.2004.08.023 BindingDB Entry DOI: 10.7270/Q25T3M75 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Synechocystis sp. (strain PCC 6803)) | BDBM50153712 (1-deoxy-L-ribulose 5-phosphate) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | 1.80E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Oregon State University Curated by ChEMBL | Assay Description Binding affinity against Synechocystis strain PCC6803 DXP reductoisomerase | Bioorg Med Chem Lett 14: 5309-12 (2004) Article DOI: 10.1016/j.bmcl.2004.08.023 BindingDB Entry DOI: 10.7270/Q25T3M75 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152427 ((E)-2,5-Dihydroxybenzaldehyde O-methyl oxime (15)) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152426 ((E)-2-Hydroxybenzaldehyde O-methyl oxime (14)) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM50149225 (3,4-Dihydroxy-benzaldehyde O-methyl-oxime | CHEMBL...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152428 ((E)-2,4-Dihydroxybenzaldehyde O-methyl oxime (16)) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152430 ((E)-3,4-Dihydroxy-5-methoxybenzaldehyde O-methyl o...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152431 ((E)-Uracil-6-carbaldehyde O-methyl oxime (19)) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152432 ((E)-4-Hydroxy-3-nitrobenzaldehyde O-methyl oxime (...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152436 ((E)-2-Fluoro-4,5-dimethoxybenzaldehyde O-methyl ox...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM152435 ((E)-4,5-Difluoro-2-hydroxybenzaldehyde O-methyl ox...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | 8.0 | n/a |
The Johns Hopkins University School of Medicine | Assay Description DXP synthase reaction mixtures containing HEPES (100 mM, pH 8.0), MgCl2 (2 mM), NaCl (5 mM), ThDP (1 mM), BSA (1 mg/mL), pyruvate (12.5-250 然), D-GA... | Chembiochem 16: 1771-81 (2015) Article DOI: 10.1002/cbic.201500119 BindingDB Entry DOI: 10.7270/Q29Z93MS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Synechocystis sp. (strain PCC 6803)) | BDBM50153715 (1,2-dideoxy-L-threo-3-hexulose 6-phosphate) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 6.30E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Oregon State University Curated by ChEMBL | Assay Description Binding affinity against Synechocystis strain PCC6803 DXP reductoisomerase | Bioorg Med Chem Lett 14: 5309-12 (2004) Article DOI: 10.1016/j.bmcl.2004.08.023 BindingDB Entry DOI: 10.7270/Q25T3M75 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (Escherichia coli) | BDBM84559 (Phosphate analogue, (s)-14) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | 7.50E+5 | -18.6 | n/a | n/a | n/a | n/a | n/a | 8.0 | 37 |
University of Bristol | Assay Description The assay was monitored spectrophotometrically through the consumption of beta-NADPH. The inhibitor assays contained inhibitor at concentrations of ... | Chembiochem 6: 1866-74 (2005) Article DOI: 10.1002/cbic.200500061 BindingDB Entry DOI: 10.7270/Q26D5RHB | |||||||||||
More data for this Ligand-Target Pair |
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