BMRB Entry 18999

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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full, SPARTA
BMRB Entry DOI: doi:10.13018/BMR18999
MolProbity Validation Chart

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Title:
solution structure of allatide O4 in solution
Deposition date:
2013-02-03
Original release date:
2015-01-12
Authors:
YANG, BAI
Citation:

Citation: BAI, YANG. "Allatides: Smallest Proteinaceous -Amylase Inhibitors from Allamanda oenotheraefolia and Their Expression in Apocynaceae Plants"  J. Biol. Chem. ., .-..

Assembly members:

Assembly members:
allatide_conf1, polymer, 30 residues, 3299.954 Da.

Natural source:

Natural source:   Common Name: Eudicots   Taxonomy ID: 52817   Superkingdom: Eukaryota   Kingdom: Viridiplantae   Genus/species: Allamanda oenotheraefolia

Experimental source:

Experimental source:   Production method: purified from the natural source   Host organism: Allamanda oenotheraefolia   Vector: na

Entity Sequences (FASTA):

Entity Sequences (FASTA):
allatide_conf1: CIAHYGKCDGIINQCCDPWL CTPPIIGFCL

Data sets:
Data typeCount
1H chemical shifts182

Additional metadata:

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

Entity Assembly IDEntity NameEntity ID
1allatide_conf11

Entities:

Entity 1, allatide_conf1 30 residues - 3299.954 Da.

1   CYSILEALAHISTYRGLYLYSCYSASPGLY
2   ILEILEASNGLNCYSCYSASPPROTRPLEU
3   CYSTHRPROPROILEILEGLYPHECYSLEU

Samples:

sample_1: allatide_conf10.5 – 1.0 mM; H2O 90%; D2O 10%

sample_conditions_1: pH: 6; 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, Guntert, Mumenthaler and Wuthrich - refinement, structure solution

NMR spectrometers:

  • Bruker Avance 700 MHz