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BMRB: 7266

2HFQ

Chemical shift assignments for protein NE1680 from Nitrosomonas europaea: Northeast Structural Genomics Consortium target NeT5

Authors

Cort, J.R., Yee, A., Arrowsmith, C.H., Kennedy, M.A.

Assembly

NE1680

Entity

1. NE1680 (polymer, Thiol state: all free), 109 monomers, 12515.72 Da Detail

MGSSHHHHHH SSGRENLYFQ GHMQIHVYDT YVKAKDGHVM HFDVFTDVRD DKKAIEFAKQ WLSSIGEEGA TVTSEECRFC HSEKAPDEVI EAIKQNGYFI YKMEGCNGS

Formula weight

12515.72 Da

Source organism

Nitrosomonas europaea

Exptl. method

NMR

Refine. method

The structure was determined using AutoStructure and refined manually

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 79.8 %, Completeness: 73.7 %, Completeness (bb): 77.1 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	73.7 % (926 of 1257)	72.9 % (474 of 650)	73.9 % (363 of 491)	76.7 % (89 of 116)
Backbone	77.1 % (503 of 652)	75.2 % (170 of 226)	78.3 % (249 of 318)	77.8 % (84 of 108)
Sidechain	71.5 % (504 of 705)	71.7 % (304 of 424)	71.4 % (195 of 273)	62.5 % (5 of 8)
Aromatic	39.7 % (62 of 156)	41.0 % (32 of 78)	37.7 % (29 of 77)	100.0 % (1 of 1)
Methyl	95.0 % (76 of 80)	95.0 % (38 of 40)	95.0 % (38 of 40)

1. NE1680

MGSSHHHHHH SSGRENLYFQ GHMQIHVYDT YVKAKDGHVM HFDVFTDVRD DKKAIEFAKQ WLSSIGEEGA TVTSEECRFC HSEKAPDEVI EAIKQNGYFI YKMEGCNGS

Show sample condition

Sample

Temperature 298 (±1) K, pH 6.5 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	NE1680	[U-13C; U-15N]	protein	1 (±0.2) mM
2	NaCl		salt	450 (±10.0) mM
3	MOPS		buffer	10 (±1.0) mM
4	sodium azide		antimicrobial agent	0.01 (±0.002) % w/v
5	H2O		solvent	90 % v/v
6	D2O		solvent	10 % v/v

LACS Plot; CA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: -0.1 ppm, Outliers: 1 Detail

LACS Plot; CB

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: -0.1 ppm, Outliers: 1 Detail

LACS Plot; HA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: -0.03 ppm, Outliers: 1 Detail

LACS Plot; CO

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: 0.31 ppm, Outliers: 1 Detail

Protein Blocks Logo

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

Release date

2006-09-04

Citation

Chemical shift assignments for protein NE1680 from Nitrosomonas europaea: Northeast Structural Genomics Consortium target NeT5
Cort, J.R., Ramelot, T.A., Yee, A., Arrowsmith, C.H., Kennedy, M.A.

Related entities 1. NE1680, : 1 : 6 entities Detail

Experiments performed 12 experiments Detail

1 1H15N HSQC