BMRB: 36105

Solution structure of arenicin-3 derivative N6

Authors

Liu, X.H., Wang, J.H.

Assembly

arenicin-3 derivative N6

Entity

1. arenicin-3 derivative N6 (polymer, Thiol state: all disulfide bound), 21 monomers, 2477.830 Da Detail

GFAWNVCVYR NGVRVCHRRA N

Formula weight

2477.83 Da

Entity Connection

disulfide 1 Detail

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ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS7:SG	1:CYS16:SG

Source organism

Arenicola marina

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 83.7 %, Completeness (bb): 77.0 % Detail

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Polymer type: polypeptide(L)

	Total	1H	13C	15N
All	83.7 % (205 of 245)	98.4 % (125 of 127)	61.3 % (57 of 93)	92.0 % (23 of 25)
Backbone	77.0 % (97 of 126)	100.0 % (44 of 44)	55.7 % (34 of 61)	90.5 % (19 of 21)
Sidechain	89.9 % (124 of 138)	97.6 % (81 of 83)	76.5 % (39 of 51)	100.0 % (4 of 4)
Aromatic	97.1 % (33 of 34)	100.0 % (17 of 17)	93.8 % (15 of 16)	100.0 % (1 of 1)
Methyl	70.0 % (14 of 20)	100.0 % (10 of 10)	40.0 % (4 of 10)

1. N6

GFAWNVCVYR NGVRVCHRRA N

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 4, Details 2.0 mM N6, 90% H2O/10% D2O

#	Name	Isotope labeling	Type	Concentration
1	N6	natural abundance	protein	2.0 mM
2	H2O	natural abundance	solvent	90 %
3	D2O	[U-2H]	solvent	10 %

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Protein Blocks Logo

Calculated from 20 models in PDB: 5Y0H, Strand ID: A Detail

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Release date

2017-08-20

Citation

Antibacterial and detoxifying activity of NZ17074 analogues with multi-layers of selective antimicrobial actions against Escherichia coli and Salmonella enteritidis
Yang, N., Liu, X., Teng, D., Li, Z., Wang, X., Mao, R., Wang, X.M., Hao, Y., Wang, J.
Sci. Rep. (2017), 7, 3392-3392, PubMed 28611436 , DOI 10.1038/s41598-017-03664-2 , Abstract

Entries sharing articles BMRB: 2 entries Detail

Related entities 1. arenicin-3 derivative N6, : 1 entities Detail

Experiments performed 4 experiments Detail