BMRB Entry 52530

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR52530

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Title:
HvfA-DSR2-3 modified peptide
Deposition date:
2024-06-27
Original release date:
2024-08-15
Authors:
Manley, Olivia; Shriver, Tucker; Robson, Scott; Ziarek, Joshua; Rosenzweig, Amy
Citation:

Citation: Manley, Olivia; Shriver, Tucker; Xu, Tian; Melendrez, Isaac; Palacios, Philip; Robson, Scott; Guo, Yisong; Kelleher, Neil; Ziarek, Joshua; Rosenzweig, Amy. "A multi-iron enzyme installs copper-binding oxazolone/thioamide pairs on a nontypeable Haemophilus inlfuenzae virulence factor"  Proc. Natl. Acad. Sci. U. S. A. 121, e2408092121-e2408092121 (2024).
PubMed: 38968106

Assembly members:

Assembly members:
entity_1, polymer, 50 residues, Formula weight is not available

Natural source:

Natural source:   Common Name: Haemophilus influenzae   Taxonomy ID: 727   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Haemophilus influenzae

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pET21a

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: MESKSSSTDNTATPCVGDKC VKTKAAEGXXGEGXXGADKA HSLEHHHHHH

Data sets:
Data typeCount
13C chemical shifts137
15N chemical shifts46
1H chemical shifts47

Additional metadata:

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

Assembly:

Entity Assembly IDEntity NameEntity ID
1HvfAmod1

Entities:

Entity 1, HvfAmod 50 residues - Formula weight is not available

1   METGLUSERLYSSERSERSERTHRASPASN
2   THRALATHRPROCYSVALGLYASPLYSCYS
3   VALLYSTHRLYSALAALAGLUGLYOXAOXA
4   GLYGLUGLYOXAOXAGLYALAASPLYSALA
5   HISSERLEUGLUHISHISHISHISHISHIS

Samples:

sample_1: HvfA peptide, modified, [U-13C; U-15N], 2.5 mM; PBS 100 mM

sample_conditions_1: pH: 7; pressure: 1 atm; temperature: 283 K

Experiments:

NameSampleSample stateSample conditions
2D 1H-15N HSQCsample_1isotropicsample_conditions_1
3D HNCOsample_1isotropicsample_conditions_1
3D HNCACBsample_1isotropicsample_conditions_1
3D HN(CO)CACBsample_1isotropicsample_conditions_1

Software:

NMRbox vv3 - chemical shift assignment, peak picking

NMRPipe - processing

NMR spectrometers:

  • Bruker AVANCE NEO 600 MHz

Related Database Links:

GB AAX88261

Download HSQC peak lists in one of the following formats:
CSV: Backbone or all simulated peaks
SPARKY: Backbone or all simulated peaks