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- ChemComp-AHL: N-HYDROXY-L-ARGININAMIDE -

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Basic information

EntryDatabase: PDB chemical components / ID: AHL
NameName: N-hydroxy-L-argininamide / Synonyms: L-ARGININE HYDROXAMATE

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Chemical information

Composition
Formula: C6H15N5O2 / Number of atoms: 28 / Formula weight: 189.216 / Formal charge: 0
Others

2g7q

ARG

Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: AHL / Model coordinates PDB-ID: 2G7Q / Parent comp.: ARG
History
Create componentMar 7, 2006
Modify descriptorJun 4, 2011
Modify synonymsMar 1, 2021
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 10.04O=C(NO)C(N)CCCNC(=[N@H])N
CACTVS 3.341N[CH](CCCNC(N)=N)C(=O)NO
OpenEye OEToolkits 1.5.0[H]N=C(N)NCCCC(C(=O)NO)N

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SMILES CANONICAL

CACTVS 3.341N[C@@H](CCCNC(N)=N)C(=O)NO
OpenEye OEToolkits 1.5.0[H]/N=C(\N)/NCCC[C@@H](C(=O)NO)N

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InChI

InChI 1.03InChI=1S/C6H15N5O2/c7-4(5(12)11-13)2-1-3-10-6(8)9/h4,13H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1

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InChIKey

InChI 1.03IXHTVNGQTIZAFS-BYPYZUCNSA-N

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SYSTEMATIC NAME

ACDLabs 10.04N-hydroxy-L-argininamide
OpenEye OEToolkits 1.5.0(2S)-2-amino-5-carbamimidamido-N-hydroxy-pentanamide

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PDB entries

Showing all 3 items

PDB-2g7q:
Structure of the Light Chain of Botulinum Neurotoxin Serotype A Bound to Small Molecule Inhibitors

PDB-2imb:
Clostridium botulinum Neurotoxin Serotype A Light Chain Inhibited by L-arginine hydroxamate

PDB-5ncd:
Crystal structure of the polysaccharide deacetylase Bc1974 from Bacillus cereus in complex with (2S)-2-amino-5-(diaminomethylideneamino)-N-hydroxypentanamide

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