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- ChemComp-RPI: phospho-arginine -

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Basic information

EntryDatabase: PDB chemical components / ID: RPI
NameName: phospho-arginine

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Chemical information

Composition
Formula: C6H15N4O5P / Number of atoms: 31 / Formula weight: 254.181 / Formal charge: 0
Others

5hbn

ARG

Type: L-peptide linking / PDB classification: ATOMP / One letter code: R / Three letter code: RPI / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5HBN / Parent comp.: ARG
History
Create componentJan 2, 2016
Modify nameJan 2, 2016
Initial releaseOct 12, 2016
Modify backboneNov 3, 2023
External linksUniChem / ChemSpider / Brenda / ChEBI / CompTox / PubChem / SureChEMBL / Wikipedia search / Google search

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Details

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SMILES

CACTVS 3.385N[CH](CCCNC(=N)N[P](O)(O)=O)C(O)=O
OpenEye OEToolkits 2.0.4C(CC(C(=O)O)N)CNC(=N)NP(=O)(O)O

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SMILES CANONICAL

CACTVS 3.385N[C@@H](CCCNC(=N)N[P](O)(O)=O)C(O)=O
OpenEye OEToolkits 2.0.4[H]/N=C(/NCCC[C@@H](C(=O)O)N)\NP(=O)(O)O

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InChI

InChI 1.03InChI=1S/C6H15N4O5P/c7-4(5(11)12)2-1-3-9-6(8)10-16(13,14)15/h4H,1-3,7H2,(H,11,12)(H5,8,9,10,13,14,15)/t4-/m0/s1

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InChIKey

InChI 1.03CCTIOCVIZPCTGO-BYPYZUCNSA-N

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PDB entries

Showing all 5 items

PDB-5hbn:
ClpC N-terminal domain with bound phospho-arginine

PDB-6fh3:
Protein arginine kinase McsB in the pArg-bound state

PDB-6fh4:
CtsR C-terminal domain with bound phospho-arginine

PDB-8b9o:
Structure of the C-terminal domain of ClpC2 from Mycobacterium smegmatis

PDB-9p39:
Streptomyces thermoviolaceus ClpC2 C-terminal domain with bound phosphoarginine

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