BDBM19472 2-oxoacetic acid::Glyoxylate::Oxoethanoic acid::glyoxylic acid::oxaldehydic acid

SMILES: OC(=O)C=O

InChI Key: InChIKey=HHLFWLYXYJOTON-UHFFFAOYSA-N

Data: 1 KI  3 ITC

PDB links: 34 PDB IDs match this monomer. 265 PDB IDs contain this monomer as substructures. 265 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 19472   

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
Dihydrodipicolinate synthase (Escherichia coli (strain K12))	BDBM19472 (2-oxoacetic acid | Glyoxylate | Oxoethanoic acid |...) Show SMILES OC(=O)C=O Show InChI InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase DrugBank KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Melbourne Curated by ChEMBL					Assay Description Inhibition of Escherichia coli DHDPS				Bioorg Med Chem 16: 9975-83 (2008) Article DOI: 10.1016/j.bmc.2008.10.026 BindingDB Entry DOI: 10.7270/Q2FN1748
					More data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 3 hits for monomerid = 19472

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
Glyoxylate Regulatory Protein (C-AllR) (Escherichia coli)	BDBM19472 (2-oxoacetic acid | Glyoxylate | Oxoethanoic acid |...)	GoogleScholar KEGG PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-1.06	7.20	-8.19	5.04	7.40	25
University of Toronto					J Biol Chem 282: 16476-91 (2007)
Acetate Operon Repressor (IclR) (Escherichia coli)	BDBM19472 (2-oxoacetic acid | Glyoxylate | Oxoethanoic acid |...)	GoogleScholar KEGG PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-4.99	-0.798	-5.79	4.88	7.40	25
University of Toronto					J Biol Chem 282: 16476-91 (2007)
Acetate Operon Repressor (C-IclR) (Escherichia coli)	BDBM19472 (2-oxoacetic acid | Glyoxylate | Oxoethanoic acid |...)	GoogleScholar KEGG PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-8.09	1.96	-10.1	6.08	7.40	25
University of Toronto					J Biol Chem 282: 16476-91 (2007)