BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

BMRB Entry 26036

Title: KYE21 structure in LPS micelles   PubMed: 28303012

Deposition date: 2016-04-18 Original release date: 2017-02-23

Authors: Datta, Aritreyee; Bhunia, Anirban; Malmsten, Martin

Citation: Singh, Shalini; Datta, Aritreyee; Schmidtchen, Artur; Bhunia, Anirban; Malmsten, Martin. "Tryptophan end-tagging for promoted lipopolysaccharide interactions and anti-inflammatory effects."  Sci. Rep. 7, 212-212 (2017).

Assembly members:
entity, polymer, 21 residues, 2751.312 Da.

Natural source:   Common Name: not available   Taxonomy ID: not available   Superkingdom: not available   Kingdom: not available   Genus/species: not available not available

Experimental source:   Production method: chemical synthesis

Entity Sequences (FASTA):
entity: KYEITTIHNLFRKLTHRLFR R

Data sets:
Data typeCount
1H chemical shifts157

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
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Assembly:

Entity Assembly IDEntity NameEntity ID
1entity1

Entities:

Entity 1, entity 21 residues - 2751.312 Da.

1   LYSTYRGLUILETHRTHRILEHISASNLEU
2   PHEARGLYSLEUTHRHISARGLEUPHEARG
3   ARG

Samples:

sample_1: entity 1 mM; sodium phosphate 10 mM; DSS 1 mM; H2O 90%; D2O, [U-2H], 10%

sample_conditions_1: ionic strength: 0.01 M; pH: 4.5; pressure: 1 atm; temperature: 298 K

Experiments:

NameSampleSample stateSample conditions
2D 1H-1H TOCSYsample_1isotropicsample_conditions_1
2D 1H-1H NOESYsample_1isotropicsample_conditions_1

Software:

CYANA v2.1, Guntert, Mumenthaler and Wuthrich - structure solution

NMR spectrometers:

  • Bruker Avance III 700 MHz