Ligand
Ligand Name:   3-hydroxypyruvate
Ligand Type:   non-polymer
Ligand ID:   COVPDB193 PubChem:   964
Synonym(s):  
  •   hydroxypyruvic acid
  • 3-hydroxypyruvic acid
  • 3-hydroxy-2-oxopropanoic acid
  • 1113-60-6
  • hydroxypyruvate
  • beta-hydroxypyruvate
  • unii-934b2khy0s
  • beta-hydroxypyruvic acid
  • 934b2khy0s
  • chebi:30841
  • oh-pyruvate
  • oh-pyr
  • beta-hydroxypyruvic acid;3-hydroxypyruvic acid
  • 4mfe
  • beta-hydoxypyruvic acid
  • schembl60708
  • chembl1230192
  • dtxsid40149588
  • zinc1532558
  • akos006378194
  • db02951
  • hy-113013
  • cs-0059352
  • c00168
  • j-002568
  • q2823271
  • beta-hydroxypyruvic acid, >=95.0% (dry substance, t)
  • 57f62db6-3e65-46d6-9d9d-f816e2d838c7
show 27 synonym(s)
DrugBank:   DB02951 ChEMBL:   CHEMBL1230192
Canonical SMILES:   OCC(=O)C(O)=O
Standard InChI:   InChI=1S/C3H4O4/c4-1-2(5)3(6)7/h4H,1H2,(H,6,7)
Molecular Formula:   C3H4O4 Mol. Weight:   104.010956 logP:   -1.3676
HBD:   2 HBA:   3
#Rotatable Bonds:   2 TPSA:   74.6

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
N-acetylneuraminate lyase P0A6L4 (NANA_ECOLI) Escherichia coli (strain K12) 3LCW 3PY
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Mandelate racemase P11444 (MANR_PSEPU) Pseudomonas putida (Arthrobacter siderocapsulatus) 4X2P 3PY
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