Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM50226181 ((3R,4S,5R,6R)-5-hydroxy-6-(4-hydroxy-3-(4-hydroxy-...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Similars | Article PubMed | n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
John Innes Centre | Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously. | J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM50330327 ((R)-7-(3-(2-aminopropan-2-yl)pyrrolidin-1-yl)-9-cy...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Achillion Pharmaceuticals Curated by ChEMBL | Assay Description Inhibition of DNA supercoiling activity of wild type Mycobacterium tuberculosis DNA gyrase A | Antimicrob Agents Chemother 54: 3478-80 (2010) Article DOI: 10.1128/AAC.00287-10 BindingDB Entry DOI: 10.7270/Q2959HS2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM50131428 (1-Cyclopropyl-6-fluoro-8-methoxy-7-(1S,7aS)-octahy...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL MMDB PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 9.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Achillion Pharmaceuticals Curated by ChEMBL | Assay Description Inhibition of DNA supercoiling activity of wild type Mycobacterium tuberculosis DNA gyrase A | Antimicrob Agents Chemother 54: 3478-80 (2010) Article DOI: 10.1128/AAC.00287-10 BindingDB Entry DOI: 10.7270/Q2959HS2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM50117914 (1-Cyclopropyl-1,4-dihydro-6-fluoro-8-methoxy-7-(3-...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | n/a | n/a | 9.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Achillion Pharmaceuticals Curated by ChEMBL | Assay Description Inhibition of DNA supercoiling activity of wild type Mycobacterium tuberculosis DNA gyrase A | Antimicrob Agents Chemother 54: 3478-80 (2010) Article DOI: 10.1128/AAC.00287-10 BindingDB Entry DOI: 10.7270/Q2959HS2 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM21690 (1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
John Innes Centre | Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously. | J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM93038 (Diospyrin) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
John Innes Centre | Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously. | J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM50107009 (5-Hydroxy-7-methyl-[1,4]naphthoquinone | 5-hydroxy...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
John Innes Centre | Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously. | J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A/B (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM21690 (1-cyclopropyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars | PDB Article PubMed | n/a | n/a | 3.77E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
CSIR-Central Institute of Medicinal and Aromatic Plants (CSIR-CIMAP) Curated by ChEMBL | Assay Description Inhibition of Mycobacterium tuberculosis DNA gyrase supercoiling activity using relaxed pBR322 as substrate after 30 mins by agarose gel electrophore... | Bioorg Med Chem 26: 4551-4559 (2018) Article DOI: 10.1016/j.bmc.2018.07.049 BindingDB Entry DOI: 10.7270/Q2XD14C3 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM93039 (Neodiospyrin) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
John Innes Centre | Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously. | J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM50131445 ((3S)-9-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL MMDB PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 5.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Achillion Pharmaceuticals Curated by ChEMBL | Assay Description Inhibition of DNA supercoiling activity of wild type Mycobacterium tuberculosis DNA gyrase A | Antimicrob Agents Chemother 54: 3478-80 (2010) Article DOI: 10.1128/AAC.00287-10 BindingDB Entry DOI: 10.7270/Q2959HS2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM93040 (Isodiospyrin | MAR-UNI-c84db004-17) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase MCE KEGG PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
John Innes Centre | Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously. | J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM93041 (Shinanolone) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase MCE KEGG PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
John Innes Centre | Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously. | J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
DNA gyrase subunit A (Mycobacterium tuberculosis (strain ATCC 25618 / H3...) | BDBM24778 (2-methyl-1,4-dihydronaphthalene-1,4-dione | 2-meth...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | n/a | n/a | >2.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
John Innes Centre | Assay Description Mycobacterium tuberculosis gyrase supercoiling, relaxation, and decatenation assays were carried out as described previously. | J Biol Chem 288: 5149-56 (2013) Article DOI: 10.1074/jbc.M112.419069 BindingDB Entry DOI: 10.7270/Q2V69H6R | |||||||||||
More data for this Ligand-Target Pair |