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- ChemComp-DGY: (2R)-2,3-DIHYDROXYPROPANOIC ACID -

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Open data


ID or keywords:

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Basic information

EntryDatabase: PDB chemical components / ID: DGY
NameName: (2R)-2,3-dihydroxypropanoic acid

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Chemical information

Composition
Formula: C3H6O4 / Number of atoms: 13 / Formula weight: 106.077 / Formal charge: 0
Others

2bo6

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: DGY / Model coordinates PDB-ID: 2BO6
History
Create componentApr 8, 2005
Modify descriptorJun 4, 2011
External linksUniChem / ChemSpider / Brenda / ChEBI / HMDB / KEGG_Ligand / Metabolights / NMRShiftDB / Nikkaji / PubChem / SureChEMBL / ZINC / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

ACDLabs 10.04O=C(O)C(O)CO
CACTVS 3.341OC[CH](O)C(O)=O
OpenEye OEToolkits 1.5.0C(C(C(=O)O)O)O

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SMILES CANONICAL

CACTVS 3.341OC[C@@H](O)C(O)=O
OpenEye OEToolkits 1.5.0C([C@H](C(=O)O)O)O

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InChI

InChI 1.03InChI=1S/C3H6O4/c4-1-2(5)3(6)7/h2,4-5H,1H2,(H,6,7)/t2-/m1/s1

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InChIKey

InChI 1.03RBNPOMFGQQGHHO-UWTATZPHSA-N

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SYSTEMATIC NAME

ACDLabs 10.04(2R)-2,3-dihydroxypropanoic acid
OpenEye OEToolkits 1.5.0(2R)-2,3-dihydroxypropanoic acid

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PDB entries

Showing all 4 items

PDB-2bo6:
DISSECTION OF MANNOSYLGLYCERATE SYNTHASE: AN ARCHETYPAL MANNOSYLTRANSFERASE

PDB-2gcg:
Ternary Crystal Structure of Human Glyoxylate Reductase/Hydroxypyruvate Reductase

PDB-3vaz:
Crystal structure of Staphylococcal GAPDH1 in a hexagonal space group

PDB-4wvc:
Crystal structure of GH63 mannosylglycerate hydrolase from Thermus thermophilus HB8 in complex with Tris and D-glycerate

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