BMRB: 30607

U-AITx-Ate1

Authors

Elnahriry, K.A., Wai, D.C.C., Norton, R.S.

Assembly

SER-LYS-TRP-ILE-CYS-ALA-ASN-ARG-SER-VAL-CYS-PRO-ILE

Entity

1. SER-LYS-TRP-ILE-CYS-ALA-ASN-ARG-SER-VAL-CYS-PRO-ILE (polymer), 13 monomers, 1476.765 Da Detail

SKWICANRSV CPI

Formula weight

1476.765 Da

Source organism

Actinia tenebrosa

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts, spectral_peak_list

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 93.8 %, Completeness (bb): 96.0 % Detail

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Polymer type: polypeptide(L)

	Total	1H
All	93.8 % (75 of 80)	93.8 % (75 of 80)
Backbone	96.0 % (24 of 25)	96.0 % (24 of 25)
Sidechain	92.7 % (51 of 55)	92.7 % (51 of 55)
Aromatic	100.0 % (6 of 6)	100.0 % (6 of 6)
Methyl	71.4 % (5 of 7)	71.4 % (5 of 7)

1. entity 1

SKWICANRSV CPI

Show sample condition

Sample #1

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1.5 mM U-AITx-Ate1, 95% H2O/5% D2O

#	Name	Isotope labeling	Type	Concentration
1	U-AITx-Ate1	natural abundance		1.5 (±2.0E-4) mM

Sample #2

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 298 K, pH 4.5, Details 1 mM U-AITx-Ate1, 95% H2O/5% D2O

#	Name	Isotope labeling	Type	Concentration
2	U-AITx-Ate1	natural abundance		1 (±0.01) mM

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Protein Blocks Logo

Calculated from 20 models in PDB: 6OQP, Strand ID: A Detail

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Release date

2019-07-21

Citation

Structural and functional characterisation of a novel peptide from the Australian sea anemone Actinia tenebrosa
Elnahriry, K.A., Wai, D.C.C., Krishnarjuna, B., Badawy, N.N., Chittoor, B., MacRaild, C.A., Williams-Noonan, B.J., Surm, J.M., Chalmers, D.K., Zhang, A.H., Peigneur, S., Mobli, M., Tytgat, J., Prentis, P., Norton, R.S.
Toxicon. (2019), 168, 104-112, PubMed 31302115 , DOI 10.1016/j.toxicon.2019.07.002 , Abstract

Experiments performed 5 experiments Detail

Chemical shift validation 3 contents Detail