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BMRB: 16253

2KHR

NMR chemical shift assignments for Rv2377c, a MbtH-like protein from Mycobacterium tuberculosis: A Structural Genomics Center for Infectious Disease (SSGCID) community request

Authors

Buchko, G.W.

Assembly

Rv2377c

Entity

1. Rv2377c (polymer, Thiol state: all free), 74 monomers, 8363.089 Da Detail

GSHMSTNPFD DDNGAFFVLV NDEDQHSLWP VFADIPAGWR VVHGEASRAA CLDYVEKNWT DLRPKSLRDA MVED

Formula weight

8363.089 Da

Source organism

Mycobacterium tuberculosis

Exptl. method

solution NMR

Refine. method

torsion angle dynamics

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 78.4 %, Completeness: 64.6 %, Completeness (bb): 69.0 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	64.6 % (539 of 834)	63.6 % (272 of 428)	64.9 % (213 of 328)	69.2 % (54 of 78)
Backbone	69.0 % (301 of 436)	66.2 % (98 of 148)	71.1 % (155 of 218)	68.6 % (48 of 70)
Sidechain	62.4 % (292 of 468)	62.1 % (174 of 280)	62.2 % (112 of 180)	75.0 % (6 of 8)
Aromatic	38.5 % (37 of 96)	41.7 % (20 of 48)	31.1 % (14 of 45)	100.0 % (3 of 3)
Methyl	80.0 % (56 of 70)	82.9 % (29 of 35)	77.1 % (27 of 35)

1. Rv2377c

GSHMSTNPFD DDNGAFFVLV NDEDQHSLWP VFADIPAGWR VVHGEASRAA CLDYVEKNWT DLRPKSLRDA MVED

Show sample condition

Sample #1

Solvent system 90% H2O/10% D2O, Pressure 1.0 atm, Temperature 298 (±0.5) K, pH 7.1 (±0.1)

#	Name	Isotope labeling	Concentration
1	Rv2377c	[U-98% 13C; U-98% 15N]	2 (±0.2) mM
2	sodium chloride	natural abundance	300 (±10.0) mM
3	TRIS	natural abundance	20 (±1.0) mM
4	DTT	natural abundance	1 (±0.1) mM
5	H2O	natural abundance	90 %
6	D2O	natural abundance	10 %

Sample #2

Solvent system 100% D2O, Pressure 1.0 atm, Temperature 298 (±0.5) K, pH 7.1 (±0.1)

#	Name	Isotope labeling	Concentration
7	Rv2377c	[U-98% 13C; U-98% 15N]	2 (±0.2) mM
8	sodium chloride	natural abundance	300 (±10.0) mM
9	TRIS	natural abundance	20 (±1.0) mM
10	DTT	natural abundance	1 (±0.1) mM
11	H2O	natural abundance	90 %
12	D2O	natural abundance	10 %

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: -0.26 ppm, Outliers: 2 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: -0.26 ppm, Outliers: 2 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: 2 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: -0.17 ppm, Outliers: 2 Detail

Protein Blocks Logo

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

Release date

2009-05-19

Citation

Solution structure of Rv2377c-founding member of the MbtH-like protein family
Buchko, G.W., Kim, C., Terwilliger, T.C., Myler, P.J.
Tuberculosis (Edinb). (2010), 90, 245-251, PubMed 20434955 , DOI 10.1016/j.tube.2010.04.002 , Abstract

Related entities 1. Rv2377c, : 1 : 3 : 21 entities Detail

Experiments performed 12 experiments Detail

1 2D 1H-15N HSQC