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- ChemComp-GLF: alpha-D-glucopyranosyl fluoride -

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Basic information

EntryDatabase: PDB chemical components / ID: GLF
NameName: alpha-D-glucopyranosyl fluoride
Synonyms: 1-FLUORO-ALPHA-1-DEOXY-D-GLUCOSE; alpha-D-glucosyl fluoride; D-glucosyl fluoride; glucosyl fluoride

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Chemical information

Composition
Formula: C6H11FO5 / Number of atoms: 23 / Formula weight: 182.147 / Formal charge: 0
Others

1cxl

Type: D-saccharide / PDB classification: ATOMS / Three letter code: GLF / Model coordinates PDB-ID: 1CXL
History
Create componentJul 8, 1999
Modify descriptorJun 4, 2011
Other modificationJul 3, 2020
Modify nameJul 17, 2020
Modify synonymsJul 17, 2020
Modify linking typeJul 17, 2020
Modify leaving atom flagJul 17, 2020
External linksUniChem / ChemSpider / 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 10.04FC1OC(C(O)C(O)C1O)CO
CACTVS 3.341OC[CH]1O[CH](F)[CH](O)[CH](O)[CH]1O
OpenEye OEToolkits 1.5.0C(C1C(C(C(C(O1)F)O)O)O)O

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SMILES CANONICAL

CACTVS 3.341OC[C@H]1O[C@H](F)[C@H](O)[C@@H](O)[C@@H]1O
OpenEye OEToolkits 1.5.0C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)F)O)O)O)O

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InChI

InChI 1.03InChI=1S/C6H11FO5/c7-6-5(11)4(10)3(9)2(1-8)12-6/h2-6,8-11H,1H2/t2-,3-,4+,5-,6+/m1/s1

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InChIKey

InChI 1.03ATMYEINZLWEOQU-DVKNGEFBSA-N

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SYSTEMATIC NAME

ACDLabs 10.04alpha-D-glucopyranosyl fluoride
OpenEye OEToolkits 1.5.0(2R,3R,4S,5S,6R)-2-fluoro-6-(hydroxymethyl)oxane-3,4,5-triol

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IUPAC CARBOHYDRATE SYMBOL

PDB-CARE 1.0a-D-Glcp1fluoro

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PDB entries

Showing all 5 items

PDB-3sco:
Crystal Structure of Rice BGlu1 E386G Mutant Complexed with alpha-Glucosyl Fluoride

PDB-3scq:
Crystal Structure of Rice BGlu1 E386A Mutant Complexed with alpha-Glucosyl Fluoride

PDB-3scs:
Crystal Structure of Rice BGlu1 E386S Mutant Complexed with alpha-Glucosyl Fluoride

PDB-4m81:
The structure of E292S glycosynthase variant of exo-1,3-beta-glucanase from Candida albicans complexed with 1-fluoro-alpha-D-glucopyranoside (donor) and p-nitrophenyl beta-D-glucopyranoside (acceptor) at 1.86A resolution

PDB-7dkt:
Crystal structure of TxGH116 E441A nucleophile mutant from Thermoanaerobacterium xylanolyticum with alpha-glucosyl fluoride

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