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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
4
hits in this display
Target
1-deoxy-D-xylulose 5-phosphate reductoisomerase
(Mycobacterium tuberculosis)
Baylor College Of Medicine
Curated by
ChEMBL
Ligand
BDBM50181154
(1-(3,4-dichlorophenyl)-3-(N-hydroxyformamido)propy...)
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Affinity Data
Ki: 1.20E+3nM
Assay Description:
Inhibition of Mycobacterium tuberculosis recombinant DXR expressed in Escherichia coli BL21 (DE3) using DXP as substrate and MgCl2 as cofactor preinc...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
Details
Article
PubMed
PDB
3D Structure (crystal)
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Target
1-deoxy-D-xylulose 5-phosphate reductoisomerase
(Escherichia coli)
Baylor College Of Medicine
Curated by
ChEMBL
Ligand
BDBM50181154
(1-(3,4-dichlorophenyl)-3-(N-hydroxyformamido)propy...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 59nM
Assay Description:
Inhibition of Escherichia coli DXR
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
1-deoxy-D-xylulose 5-phosphate reductoisomerase
(Escherichia coli)
Baylor College Of Medicine
Curated by
ChEMBL
Ligand
BDBM50181154
(1-(3,4-dichlorophenyl)-3-(N-hydroxyformamido)propy...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 59nM
Assay Description:
Inhibition of recombinant Escherichia coli DXR
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
1-deoxy-D-xylulose 5-phosphate reductoisomerase
(Mycobacterium tuberculosis)
Baylor College Of Medicine
Curated by
ChEMBL
Ligand
BDBM50181154
(1-(3,4-dichlorophenyl)-3-(N-hydroxyformamido)propy...)
Copy SMILES
Copy InChI
Affinity Data
Kd: 120nM
Assay Description:
Binding affinity to Mycobacterium tuberculosis DXR assessed as dissociation constant by spectrofluorimetric analysis in presence of NADPH and MnCl2
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
PDB
Similars
In Depth
Details
Article
PubMed
PDB
3D Structure (crystal)
Copy BDB DOI