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- ChemComp-MLY: N-DIMETHYL-LYSINE -

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Basic information

EntryDatabase: PDB chemical components / ID: MLY
NameName: N-dimethyl-lysine

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Chemical information

Composition
Formula: C8H18N2O2 / Number of atoms: 30 / Formula weight: 174.241 / Formal charge: 0
Others

2mys

LYS

TRG

Type: L-PEPTIDE LINKING / PDB classification: ATOMP / One letter code: K / Three letter code: MLY / Model coordinates PDB-ID: 2MYS / Parent comp.: LYS / Replaces: TRG
History
Create componentJul 8, 1999
Modify descriptorJun 4, 2011
Modify backboneNov 3, 2023
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(O)C(N)CCCCN(C)C
CACTVS 3.341CN(C)CCCC[CH](N)C(O)=O
OpenEye OEToolkits 1.5.0CN(C)CCCCC(C(=O)O)N

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SMILES CANONICAL

CACTVS 3.341CN(C)CCCC[C@H](N)C(O)=O
OpenEye OEToolkits 1.5.0CN(C)CCCC[C@@H](C(=O)O)N

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InChI

InChI 1.03InChI=1S/C8H18N2O2/c1-10(2)6-4-3-5-7(9)8(11)12/h7H,3-6,9H2,1-2H3,(H,11,12)/t7-/m0/s1

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InChIKey

InChI 1.03XXEWFEBMSGLYBY-ZETCQYMHSA-N

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SYSTEMATIC NAME

ACDLabs 10.04N~6~,N~6~-dimethyl-L-lysine
OpenEye OEToolkits 1.5.0(2S)-2-amino-6-dimethylamino-hexanoic acid

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PDB entries

Showing all 3 items

PDB-2r58:
Crystal Structure of the two MBT repeats from Sex-Comb on Midleg (SCM) in Complex with Di-Methyl Lysine

PDB-2rhu:
Crystal structure of the 3-MBT repeats from human L3MBTL1 bound to dimethyl-lysine and in chimera with histone H3.3(28-34)

PDB-2rhx:
Crystal structure of the 3-MBT repeats from human L3MBTL1 bound to dimethyl-lysine

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