BMRB: 4771

Assignment of the 1H, 15N and 13C resonances of the C-terminal domain of the TolA protein of Escherichia coli, involved in the cell envelope integrity

Authors

Deprez, C., Blanchard, L., Simorre, J., Gavioli, M., Guerlesquin, F., Lazdunski, C., Lloubes, R., Marion, D.

Assembly

tola3

Entity

1. tola3 (polymer, Thiol state: all disulfide bound), 106 monomers, 11311.68 Da Detail

AEFGNTKNNG ASGADINNYA GQIKSAIESK FYDASSYAGK TCTLRIKLAP DGMLLDIKPE GGDPALCQAA LAAAKLAKIP KPPSQAVYEV FKNAPLDFKP HHHHHH

Formula weight

11311.68 Da

Entity Connection

disulfide 1 Detail

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ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS42:SG	1:CYS67:SG

Source organism

Escherichia coli

Exptl. method

NMR

Refine. method

2 step simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 96.2 %, Completeness: 83.5 %, Completeness (bb): 92.6 % Detail

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Polymer type: polypeptide(L)

	Total	1H	13C	15N
All	83.5 % (998 of 1195)	81.6 % (507 of 621)	85.2 % (398 of 467)	86.9 % (93 of 107)
Backbone	92.6 % (574 of 620)	93.9 % (199 of 212)	91.9 % (285 of 310)	91.8 % (90 of 98)
Sidechain	75.6 % (509 of 673)	74.1 % (303 of 409)	79.6 % (203 of 255)	33.3 % (3 of 9)
Aromatic	10.4 % (10 of 96)	10.4 % (5 of 48)	10.4 % (5 of 48)
Methyl	100.0 % (104 of 104)	100.0 % (52 of 52)	100.0 % (52 of 52)

1. TolA

AEFGNTKNNG ASGADINNYA GQIKSAIESK FYDASSYAGK TCTLRIKLAP DGMLLDIKPE GGDPALCQAA LAAAKLAKIP KPPSQAVYEV FKNAPLDFKP HHHHHH

Show sample condition

Sample

Temperature 300 (±1) K, pH 6.8 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	TolA	[U-15N]		0.5 mM

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LACS Plot; CA

Referencing offset: 0.45 ppm, Outliers: 1 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
1H	H2O	protons	4.6388 ppm	internal	direct	1.0
15N	liquid NH3	nitrogen	0.0 ppm	external	indirect	0.1013291
13C	DSS	methyl protons	0.0 ppm	external	indirect	0.2514495

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LACS Plot; CB

Referencing offset: 0.45 ppm, Outliers: 1 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
1H	H2O	protons	4.6388 ppm	internal	direct	1.0
15N	liquid NH3	nitrogen	0.0 ppm	external	indirect	0.1013291
13C	DSS	methyl protons	0.0 ppm	external	indirect	0.2514495

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LACS Plot; HA

Referencing offset: 0.09 ppm, Outliers: 1 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
1H	H2O	protons	4.6388 ppm	internal	direct	1.0
15N	liquid NH3	nitrogen	0.0 ppm	external	indirect	0.1013291
13C	DSS	methyl protons	0.0 ppm	external	indirect	0.2514495

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LACS Plot; CO

Referencing offset: 0.47 ppm, Outliers: 2 Detail

Show chemical shift referencing parameters

Chemical shift reference

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
1H	H2O	protons	4.6388 ppm	internal	direct	1.0
15N	liquid NH3	nitrogen	0.0 ppm	external	indirect	0.1013291
13C	DSS	methyl protons	0.0 ppm	external	indirect	0.2514495

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Protein Blocks Logo

Calculated from 16 models in PDB: 1S62, Strand ID: A Detail

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Release date

2000-10-29

Citation

Assignment of the 1H, 15N and 13C resonances of the C-terminal domain of the TolA protein of Escherichia coli, involved in cell envelope integrity
Deprez, C., Blanchard, L., Simorre, J., Gavioli, M., Guerlesquin, F., Lazdunski, C., Lloubes, R., Marion, D.
J. Biomol. NMR (2000), 18, 179-180, PubMed 11101224 , DOI: , Abstract

Related entities 1. tola3, : 1 : 4 : 5 entities Detail

Interaction partners 1. tola3, : 6 interactors Detail

Experiments performed 1 experiments Detail