BMRB Entry 21047

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR21047

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Title:
AIP-IV
Deposition date:
2013-10-08
Original release date:
2013-12-10
Authors:
Tal-Gan, Yftah; Ivancic, Monika; Cornilescu, Gabriel; Cornilescu, Claudia; Blackwell, Helen
Citation:

Citation: Tal-Gan, Yftah; Ivancic, Monika; Cornilescu, Gabriel; Cornilescu, Claudia; Blackwell, Helen. "Structural Characterization of an Autoinducing Peptide and Abiotic Analogs Reveals Key Features Essential for Activation and Inhibition of an AgrC Quorum Sensing Receptor in Staphylococcus aureus"  J. Am. Chem. Soc. ., .-..

Assembly members:

Assembly members:
AIP-IV, polymer, 8 residues, 1009 Da.

Natural source:

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

Experimental source:

Experimental source:   Production method: .

Entity Sequences (FASTA):

Entity Sequences (FASTA):
AIP-IV: YSTCYFIM

Data sets:
Data typeCount
1H chemical shifts54

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
  • Hide all

Assembly:

Entity Assembly IDEntity NameEntity ID
1AIP-IV1

Entities:

Entity 1, AIP-IV 8 residues - 1009 Da.

1   TYRSERTHRCYSTYRPHEILEMET

Samples:

sample_1: AIP-IV 1 mM; H2O 70%; CD3CN 30%

sample_conditions_1: pH: 3.65; temperature: 298 K

Experiments:

NameSampleSample stateSample conditions
2D 1H-1H TOCSYsample_1isotropicsample_conditions_1
2D 1H-1H COSYsample_1isotropicsample_conditions_1
2D 1H-1H ROESYsample_1isotropicsample_conditions_1

Software:

X-PLOR NIH, Schwieters, Kuszewski, Tjandra and Clore - structure solution

SPARKY, Goddard - chemical shift assignment

NMR spectrometers:

  • Varian INOVA 600 MHz