BMRB: 25670

Solution Structure of Enterocin HF, an Antilisterial Bacteriocin Produced by Enterococcus faecium M3K31

Authors

Arbulu, S., Lohans, C.T., Cintas, L.M., Herranz, C., van Belkum, M.J., Vederas, J.C., Hernandez, P.E.

Assembly

Enterocin HF

Entity

1. Enterocin HF (polymer, Thiol state: all disulfide bound), 43 monomers, 4330.861 Da Detail

KYYGNGVSCN KKGCSVDWGK AIGIIGNNAA ANLTTGGKAG WKG

Formula weight

4330.861 Da

Entity Connection

disulfide 1 Detail

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ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS9:SG	1:CYS14:SG

Source organism

Enterococcus faecium

Exptl. method

solution NMR

Refine. method

Torsion angle dynamics

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 95.3 %, Completeness: 85.7 %, Completeness (bb): 92.7 % Detail

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Polymer type: polypeptide(L)

	Total	1H
All	85.7 % (203 of 237)	85.7 % (203 of 237)
Backbone	92.7 % (89 of 96)	92.7 % (89 of 96)
Sidechain	80.9 % (114 of 141)	80.9 % (114 of 141)
Aromatic	100.0 % (20 of 20)	100.0 % (20 of 20)
Methyl	100.0 % (19 of 19)	100.0 % (19 of 19)

1. entity

KYYGNGVSCN KKGCSVDWGK AIGIIGNNAA ANLTTGGKAG WKG

Show sample condition

Sample

Solvent system 50% d2-trifluoroethanol : 50% water, Pressure 1 atm, Temperature 273 K

#	Name	Isotope labeling	Type	Concentration
1	entity	natural abundance		0.76 mM
2	TFE	d2-TFE		50 %
3	DSS	natural abundance		0.01 %
4	H2O	natural abundance		50 %

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Calculated from 20 models in PDB: 2N4K, Strand ID: A Detail

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Release date

2015-11-22

Citation

Solution Structure of Enterocin HF, an Antilisterial Bacteriocin Produced by Enterococcus faecium M3K31
Arbulu, S., Lohans, C.T., Cintas, L.M., Herranz, C., van Belkum, M.J., Vederas, J.C., Hernandez, P.E.
J. Agric. Food Chem. (2015), 63, 10689-10695, PubMed 26585399 , DOI 10.1021/acs.jafc.5b03882 , Abstract

Related entities 1. Enterocin HF, : 1 : 1 : 19 entities Detail

Experiments performed 2 experiments Detail