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BMRB: 27893

Constutively active Mutant D99N LicT-CAT-PRD1

Authors

Yang, Y., Declerck, N.

Assembly

D99-LicT-CAT-PRD1 dimer

Entity

1. D99-LicT-CAT-PRD1 dimer (polymer, Thiol state: all free), 175 monomers, 19906.67 × 2 Da Detail

MKIAKVINNN VISVVNEQGK ELVVMGRGLA FQKKSGDDVD EARIEKVFTL DNKDVSEKFK TLLYDIPIEC MEVSEEIISY AKLQLGKKLN DSIYVSLTNH INFAIQRNQK GLDIKNALLW ETKRLYKDEF AIGKEALVMV KNKTGVSLPE DEAGFIALHI VNAELNELQH HHHHH

Total weight

39813.34 Da

Max. entity weight

19906.67 Da

Source organism

Bacillus subtilis

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 97.1 %, Completeness: 72.4 %, Completeness (bb): 87.5 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	72.4 % (1523 of 2105)	75.1 % (823 of 1096)	65.3 % (533 of 816)	86.5 % (167 of 193)
Backbone	87.5 % (915 of 1046)	95.2 % (340 of 357)	79.5 % (410 of 516)	95.4 % (165 of 173)
Sidechain	56.0 % (686 of 1225)	65.4 % (483 of 739)	43.1 % (201 of 466)	10.0 % (2 of 20)
Aromatic	41.2 % (56 of 136)	82.4 % (56 of 68)	0.0 % (0 of 67)	0.0 % (0 of 1)
Methyl	97.8 % (219 of 224)	98.2 % (110 of 112)	97.3 % (109 of 112)

1. LicT

MKIAKVINNN VISVVNEQGK ELVVMGRGLA FQKKSGDDVD EARIEKVFTL DNKDVSEKFK TLLYDIPIEC MEVSEEIISY AKLQLGKKLN DSIYVSLTNH INFAIQRNQK GLDIKNALLW ETKRLYKDEF AIGKEALVMV KNKTGVSLPE DEAGFIALHI VNAELNELQH HHHHH

Show sample condition

Sample #1

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 308 K, pH 8

#	Name	Isotope labeling	Concentration
1	LicT	[U-99% 13C; U-99% 15N]	800 (±25.0) uM
2	TRIS	natural abundance	10 (±3.0) mM
3	sodium chloride	natural abundance	200 (±10.0) mM
4	DTT	natural abundance	1 (±0.1) mM
5	EDTA	natural abundance	0.2 (±0.05) mM
6	benzamidine	natural abundance	0.2 (±0.05) mM

Sample #2

Solvent system 100% D2O, Pressure 1 atm, Temperature 308 K, pH 8

#	Name	Isotope labeling	Concentration
7	LicT	[U-99% 13C; U-99% 15N]	350 (±25.0) uM
8	TRIS	natural abundance	10 (±3.0) mM
9	sodium chloride	natural abundance	200 (±10.0) mM
10	DTT	natural abundance	1 (±0.1) mM
11	EDTA	natural abundance	0.2 (±0.05) mM
12	benzamidine	natural abundance	0.2 (±0.05) mM

Sample #3

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 308 K, pH 8

#	Name	Isotope labeling	Concentration
13	LicT	[U-99% 13C; U-99% 15N]	600 (±25.0) uM
14	Phosphate	natural abundance	20 (±3.0) mM
15	sodium chloride	natural abundance	200 (±10.0) mM
16	DTT	natural abundance	1 (±0.1) mM
17	EDTA	natural abundance	0.2 (±0.05) mM
18	benzamidine	natural abundance	0.2 (±0.05) mM

LACS Plot; CA

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

Referencing offset: -0.44 ppm, Outliers: 1 Detail

LACS Plot; CB

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

Referencing offset: -0.44 ppm, Outliers: 1 Detail

LACS Plot; HA

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

Referencing offset: -0.05 ppm, Outliers: 1 Detail

LACS Plot; CO

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

Referencing offset: -0.12 ppm, Outliers: 2 Detail

Release date

2019-05-07

Citation

NMR chemical shift assignment of a constitutively active fragment of the antitermination protein LicT
Yang, Y., Declerck, N., Demene, H.
Biomol. NMR Assign. (2020), 14, 19-23, PubMed 31612430 , DOI 10.1007/s12104-019-09914-w , Abstract

Related entities 1. D99-LicT-CAT-PRD1 dimer, : 17 entities Detail

Experiments performed 11 experiments Detail

1 2D 1H-15N HSQC