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BMRB: 19736

2MXN

1H, 13C, and 15N Chemical Shift Assignments of a the mature form of Trypanosoma brucei 1-C-Grx1

Authors

Sturlese, M., Lelli, M., Bellanda, M., Manta, B., Comini, M.

Assembly

1-C-Grx1

Entity

1. 1-C-Grx1 (polymer, Thiol state: all free), 145 monomers, 16063.33 Da Detail

GAMSTSGIGG DVRDIEETHP DFQPRLVSAD LAEDEIAMVK KDIDDTIKSE DVVTFIKGLP EAPMCAYSKR MIDVLEALGL EYTSFDVLAH PVVRSYVKEV SEWPTIPQLF IKAEFVGGLD IVTKMLESGD LKKMLRDKGI TCRDL

Formula weight

16063.33 Da

Source organism

Trypanosoma brucei

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 97.9 %, Completeness: 89.5 %, Completeness (bb): 95.2 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	89.5 % (1489 of 1663)	87.7 % (754 of 860)	90.9 % (602 of 662)	94.3 % (133 of 141)
Backbone	95.2 % (815 of 856)	94.5 % (277 of 293)	96.0 % (408 of 425)	94.2 % (130 of 138)
Sidechain	85.0 % (801 of 942)	84.1 % (477 of 567)	86.3 % (321 of 372)	100.0 % (3 of 3)
Aromatic	80.9 % (76 of 94)	80.9 % (38 of 47)	80.4 % (37 of 46)	100.0 % (1 of 1)
Methyl	84.1 % (153 of 182)	82.4 % (75 of 91)	85.7 % (78 of 91)

1. 1-C-Grx1

GAMSTSGIGG DVRDIEETHP DFQPRLVSAD LAEDEIAMVK KDIDDTIKSE DVVTFIKGLP EAPMCAYSKR MIDVLEALGL EYTSFDVLAH PVVRSYVKEV SEWPTIPQLF IKAEFVGGLD IVTKMLESGD LKKMLRDKGI TCRDL

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 298 K, pH 7

#	Name	Isotope labeling	Concentration
1	1-C-Grx1	[U-13C; U-15N]	1.8 mM
2	DTT	natural abundance	5 mM
3	sodium phosphate	natural abundance	50 mM
4	sodium chloride	natural abundance	150 mM
5	sodium azide	natural abundance	0.05 % w/v
6	EDTA	natural abundance	1 mM
7	PMSF	natural abundance	0.2 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: -0.07 ppm, Outliers: 2 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: -0.07 ppm, Outliers: 2 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: 3 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: 0.04 ppm, Outliers: 2 Detail

Protein Blocks Logo

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

Release date

2014-11-06

Citation

(1)H, (13)C and (15)N resonance assignment of the mature form of monothiol glutaredoxin 1 from the pathogen Trypanosoma brucei
Sturlese, M., Lelli, M., Manta, B., Mammi, S., Comini, M., Bellanda, M.
Biomol. NMR Assign. (2015), 9, 143-146, PubMed 24830542 , DOI 10.1007/s12104-014-9561-3 , Abstract

Related entities 1. 1-C-Grx1, : 22 entities Detail

Experiments performed 13 experiments Detail

1 2D 1H-15N HSQC