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BMRB: 15936

6N61

Sequence-specific 1H, 15N, resonance assignments of nine 1H-{15N} HSQC spectras for the whole region 4 of Escherichia coli RNA polymerase sigma70 subunit recorded at TFE concentrations increasing in the range of 0-30%

Authors

Kaczka, P., Polkowska, A.

Assembly

4 sigma70

Entity

1. 4 sigma70 (polymer, Thiol state: not present), 107 monomers, 12163.63 Da Detail

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Formula weight

12163.63 Da

Source organism

Escherichia coli

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chem. Shift Complete1

Sequence coverage: 95.3 %, Completeness: 50.2 %, Completeness (bb): 76.3 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	50.2 % (373 of 743)	42.5 % (270 of 636)	96.3 % (103 of 107)
Backbone	76.3 % (245 of 321)	66.4 % (144 of 217)	97.1 % (101 of 104)
Sidechain	30.3 % (128 of 422)	30.1 % (126 of 419)	66.7 % (2 of 3)
Aromatic	5.4 % (2 of 37)	5.4 % (2 of 37)
Methyl	47.5 % (28 of 59)	47.5 % (28 of 59)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete2

Sequence coverage: 95.3 %, Completeness: 43.8 %, Completeness (bb): 72.7 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	43.8 % (651 of 1486)	35.1 % (447 of 1272)	95.3 % (204 of 214)
Backbone	72.7 % (467 of 642)	61.1 % (265 of 434)	97.1 % (202 of 208)
Sidechain	21.8 % (184 of 844)	21.7 % (182 of 838)	33.3 % (2 of 6)
Aromatic	2.7 % (2 of 74)	2.7 % (2 of 74)
Methyl	34.7 % (41 of 118)	34.7 % (41 of 118)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete3

Sequence coverage: 94.4 %, Completeness: 42.5 %, Completeness (bb): 71.4 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	42.5 % (947 of 2229)	33.7 % (643 of 1908)	94.7 % (304 of 321)
Backbone	71.4 % (688 of 963)	59.3 % (386 of 651)	96.8 % (302 of 312)
Sidechain	20.5 % (259 of 1266)	20.4 % (257 of 1257)	22.2 % (2 of 9)
Aromatic	17.1 % (19 of 111)	17.1 % (19 of 111)
Methyl	33.3 % (59 of 177)	33.3 % (59 of 177)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete4

Sequence coverage: 95.3 %, Completeness: 42.2 %, Completeness (bb): 70.9 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	42.2 % (1254 of 2972)	33.3 % (848 of 2544)	94.9 % (406 of 428)
Backbone	70.9 % (910 of 1284)	58.4 % (507 of 868)	96.9 % (403 of 416)
Sidechain	20.4 % (344 of 1688)	20.3 % (341 of 1676)	25.0 % (3 of 12)
Aromatic	12.8 % (19 of 148)	12.8 % (19 of 148)
Methyl	30.1 % (71 of 236)	30.1 % (71 of 236)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete5

Sequence coverage: 93.5 %, Completeness: 41.5 %, Completeness (bb): 70.5 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	41.5 % (1543 of 3715)	32.6 % (1037 of 3180)	94.6 % (506 of 535)
Backbone	70.5 % (1132 of 1605)	58.0 % (629 of 1085)	96.7 % (503 of 520)
Sidechain	19.5 % (411 of 2110)	19.5 % (408 of 2095)	20.0 % (3 of 15)
Aromatic	10.8 % (20 of 185)	10.8 % (20 of 185)
Methyl	28.5 % (84 of 295)	28.5 % (84 of 295)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete6

Sequence coverage: 94.4 %, Completeness: 39.9 %, Completeness (bb): 69.6 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	39.9 % (1779 of 4458)	30.7 % (1173 of 3816)	94.4 % (606 of 642)
Backbone	69.6 % (1341 of 1926)	56.7 % (738 of 1302)	96.6 % (603 of 624)
Sidechain	17.3 % (438 of 2532)	17.3 % (435 of 2514)	16.7 % (3 of 18)
Aromatic	9.0 % (20 of 222)	9.0 % (20 of 222)
Methyl	25.4 % (90 of 354)	25.4 % (90 of 354)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete7

Sequence coverage: 94.4 %, Completeness: 39.8 %, Completeness (bb): 69.6 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	39.8 % (2071 of 5201)	30.6 % (1364 of 4452)	94.4 % (707 of 749)
Backbone	69.6 % (1563 of 2247)	56.6 % (860 of 1519)	96.6 % (703 of 728)
Sidechain	17.2 % (508 of 2954)	17.2 % (504 of 2933)	19.0 % (4 of 21)
Aromatic	7.7 % (20 of 259)	7.7 % (20 of 259)
Methyl	24.5 % (101 of 413)	24.5 % (101 of 413)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete8

Sequence coverage: 96.3 %, Completeness: 40.0 %, Completeness (bb): 69.7 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	40.0 % (2375 of 5944)	30.8 % (1568 of 5088)	94.3 % (807 of 856)
Backbone	69.7 % (1791 of 2568)	56.9 % (988 of 1736)	96.5 % (803 of 832)
Sidechain	17.3 % (584 of 3376)	17.3 % (580 of 3352)	16.7 % (4 of 24)
Aromatic	6.8 % (20 of 296)	6.8 % (20 of 296)
Methyl	24.4 % (115 of 472)	24.4 % (115 of 472)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete9

Sequence coverage: 94.4 %, Completeness: 39.9 %, Completeness (bb): 69.8 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	39.9 % (2671 of 6687)	30.8 % (1763 of 5724)	94.3 % (908 of 963)
Backbone	69.8 % (2017 of 2889)	57.0 % (1114 of 1953)	96.5 % (903 of 936)
Sidechain	17.2 % (654 of 3798)	17.2 % (649 of 3771)	18.5 % (5 of 27)
Aromatic	6.0 % (20 of 333)	6.0 % (20 of 333)
Methyl	23.9 % (127 of 531)	23.9 % (127 of 531)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chem. Shift Complete10

Sequence coverage: 95.3 %, Completeness: 40.8 %, Completeness (bb): 70.2 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹⁵N
All	40.8 % (3031 of 7430)	31.8 % (2021 of 6360)	94.4 % (1010 of 1070)
Backbone	70.2 % (2253 of 3210)	57.6 % (1250 of 2170)	96.4 % (1003 of 1040)
Sidechain	18.4 % (776 of 4220)	18.4 % (770 of 4190)	20.0 % (6 of 30)
Aromatic	6.8 % (25 of 370)	6.8 % (25 of 370)
Methyl	25.4 % (150 of 590)	25.4 % (150 of 590)

1. 4 sigma70

MGSSHHHHHH SSGLVPRGSH MLELPLDSAT TESLRAATHD VLAGLTAREA KVLRMRFGID MNTDYTLEEV GKQFDVTRER IRQIEAKALR KLRHPSRSEV LRSFLDD

Show sample condition

Sample #1

Solvent system water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details no TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
1	4 sigma70	[U-13C; U-15N]		3 mM

Sample #2

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 0,3% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
2	4 sigma70	[U-13C; U-15N]		3 mM
3	TFE			0.3 %

Sample #3

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 2% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
4	4 sigma70	[U-13C; U-15N]		3 mM
5	TFE			2 %

Sample #4

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 4% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
6	4 sigma70	[U-13C; U-15N]		3 mM
7	TFE			4 %

Sample #5

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 6% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
8	4 of sigma70	[U-13C; U-15N]		3 mM
9	TFE			6 %

Sample #6

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 10% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
10	4 sigma70	[U-13C; U-15N]		3 mM
11	TFE			10 %

Sample #7

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 12% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
12	4 sigma70	[U-13C; U-15N]		3 mM
13	TFE			12 %

Sample #8

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 15% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
14	4 sigma70	natural abundance		3 mM
15	TFE			15 %

Sample #9

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 20% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
16	4 sigma70	[U-13C; U-15N]		3 mM
17	TFE			20 %

Sample #10

Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Release date

2009-11-19

Citation

Backbone dynamics of TFE-induced native-like fold of region 4 of Escherichia coli RNA polymerase sigma70 subunit
Kaczka, P., Polkowska-Nowakowska, A., Bolewska, K., Zhukov, I., Poznaski, J., Wierzchowski, K.L.
Proteins (2010), 78, 754-768, PubMed 19847776 , DOI 10.1002/prot.22607 , Abstract

Related entities 1. 4 sigma70, : 1 : 94 : 18 entities Detail

Sample

State isotropic, Solvent system trifluoroethanol/water, Pressure 1 atm, Temperature 298 K, pH 4.55, Details 30% TFE (2,2,2-trifluoroehtanol)

#	Name	Isotope labeling	Type	Concentration
18	4 sigma70	[U-13C; U-15N]		3 mM
19	TFE			30 %

Chemical shift validation 12 contents Detail

Properties

Input source #1: Assigned chemical shifts - Assigned chemical shifts	bmr15936_3.str
Diamagnetism of the molecular assembly	True (excluding Oxygen atoms)
Whether the assembly has a disulfide bond	None
Whether the assembly has a other bond	None
Whether the assembly contains a cyclic polymer	None
Overall data processing status	OK

Disulfide bonds

None

Other bonds (neither disulfide, covalent nor hydrogen bonds, e.g. Zinc–sulphur bond)

None

Non-standard residues

None

Content subtype: bmr15936_3.str

#	Content subtype	Saveframe	Status	# of rows	Sequence coverage (%)
1	Assigned chemical shifts	assigned_chem_shift_list_1	OK	200	93.5 (chain: 1, length: 107)
2	Assigned chemical shifts	assigned_chem_shift_list_2	OK	200	93.5 (chain: 1, length: 107)
3	Assigned chemical shifts	assigned_chem_shift_list_3	OK	200	93.5 (chain: 1, length: 107)
4	Assigned chemical shifts	assigned_chem_shift_list_4	OK	200	93.5 (chain: 1, length: 107)
5	Assigned chemical shifts	assigned_chem_shift_list_5	OK	200	93.5 (chain: 1, length: 107)
6	Assigned chemical shifts	assigned_chem_shift_list_6	OK	200	93.5 (chain: 1, length: 107)
7	Assigned chemical shifts	assigned_chem_shift_list_7	OK	200	93.5 (chain: 1, length: 107)
8	Assigned chemical shifts	assigned_chem_shift_list_8	OK	200	93.5 (chain: 1, length: 107)
9	Assigned chemical shifts	assigned_chem_shift_list_9	OK	200	93.5 (chain: 1, length: 107)
10	Assigned chemical shifts	assigned_chem_shift_list_10	OK	200	93.5 (chain: 1, length: 107)
1	Chemical shift references	chemical_shift_reference_1	OK	3	No information

Assigned chemical shifts

Saveframe: assigned_chem_shift_list_1
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹H chemical shifts: 100
  - ¹⁵N chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_2
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_3
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_4
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_5
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_6
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_7
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_8
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_9
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1
Saveframe: assigned_chem_shift_list_10
- Status: OK
- Sequence coverage of experimental data
  - Entity_assembly_ID: 1, Chain length: 107, Sequence coverage: 93.5%
- Total number of assignments
  - ¹⁵N chemical shifts: 100
  - ¹H chemical shifts: 100
- Completeness of assignments
  - Entity_assemble_ID: 1
- Histogram of normalized assigned chemical shifts
- Random coil index and derived parameters (S² and NMR RMSD)
  - Chain_ID: 1

Keywords E. coli RNA polymerase, NMR assignment, sigma70, TFE titration

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	636	100	15.7
¹⁵N chemical shifts	119	100	84.0

Atom group	# of target shifts	# of assigned shifts	Completeness (%)
¹H chemical shifts	217	100	46.1
¹⁵N chemical shifts	104	100	96.2

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Found 1 Document (1.007 seconds)

BMRB: 15936

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