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 (386/389 > 99%)† (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 (386/389 > 99%)† (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 | n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis DXR assessed as reduction of 1-deoxy-D-xylulose 5-phosphate into 2-C-methyl-D-erythritol-4-phosphate measure... | Bioorg Med Chem Lett 21: 5403-7 (2011) Article DOI: 10.1016/j.bmcl.2011.07.005 BindingDB Entry DOI: 10.7270/Q290246H | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (386/389 > 99%)† (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 | n/a | n/a | 80 | 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 Mn2+ as cofactor preincu... | 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 (386/389 > 99%)† (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 | n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis DXR assessed as NADPH-dependent conversion of 1-deoxy-D-xylulose 5-phosphate to 2-C-methyl-D-erythritol 4-ph... | J Biol Chem 282: 19905-16 (2007) Article DOI: 10.1074/jbc.M701935200 BindingDB Entry DOI: 10.7270/Q28G8MK1 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (386/389 > 99%)† (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 | n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Uppsala University Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis DXR using DXP as substrate assessed as formation of MEP measured every 5 secs for 180 secs by spectrophotome... | J Med Chem 56: 6190-9 (2013) Article DOI: 10.1021/jm4006498 BindingDB Entry DOI: 10.7270/Q2S183W1 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (386/389 > 99%)† (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 | n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
Lehrstuhl für Biochemie Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis IspC by photometric assay | J Med Chem 56: 8151-62 (2013) Article DOI: 10.1021/jm4012559 BindingDB Entry DOI: 10.7270/Q2JH3NN8 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (386/389 > 99%)† (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 | n/a | n/a | 440 | n/a | n/a | n/a | n/a | n/a | n/a |
George Washington University Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis Dxr | Bioorg Med Chem Lett 24: 649-53 (2014) Article DOI: 10.1016/j.bmcl.2013.11.067 BindingDB Entry DOI: 10.7270/Q24Q7WGS | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
1-deoxy-D-xylulose 5-phosphate reductoisomerase (386/389 > 99%)† (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 | n/a | n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a |
Uppsala University Curated by ChEMBL | Assay Description Binding affinity to Mycobacterium tuberculosis DXR assessed as dissociation constant by spectrofluorimetric analysis in presence of NADPH and MnCl2 | J Med Chem 56: 6190-9 (2013) Article DOI: 10.1021/jm4006498 BindingDB Entry DOI: 10.7270/Q2S183W1 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |