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BMRB: 19782

6GCJ

Chemical shifts assignments of the RodA hydrophobin from the opportunistic pathogen Aspergillus fumigatus

Authors

Pille, A., Kwan, A., Cheung, I., Hampsey, M., Delepierre, M., Sunde, M., Guijarro, J.

Assembly

RodA

Entity

1. RodA (polymer, Thiol state: all disulfide bound), 142 monomers, 14434.27 Da Detail

SLPQHDVNAA GNGVGNKGNA NVRFPVPDDI TVKQATEKCG DQAQLSCCNK ATYAGDVTDI DEGILAGTLK NLIGGGSGTE GLGLFNQCSK LDLQIPVIGI PIQALVNQKC KQNIACCQNS PSDASGSLIG LGLPCIALGS IL

Formula weight

14434.27 Da

Source organism

Aspergillus fumigatus

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 98.0 %, Completeness (bb): 98.9 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	98.0 % (1488 of 1519)	98.3 % (771 of 784)	97.6 % (565 of 579)	97.4 % (152 of 156)
Backbone	98.9 % (829 of 838)	99.7 % (295 of 296)	98.0 % (399 of 407)	100.0 % (135 of 135)
Sidechain	97.3 % (782 of 804)	97.5 % (476 of 488)	98.0 % (289 of 295)	81.0 % (17 of 21)
Aromatic	81.3 % (26 of 32)	87.5 % (14 of 16)	75.0 % (12 of 16)
Methyl	100.0 % (176 of 176)	100.0 % (88 of 88)	100.0 % (88 of 88)

1. RodA

SLPQHDVNAA GNGVGNKGNA NVRFPVPDDI TVKQATEKCG DQAQLSCCNK ATYAGDVTDI DEGILAGTLK NLIGGGSGTE GLGLFNQCSK LDLQIPVIGI PIQALVNQKC KQNIACCQNS PSDASGSLIG LGLPCIALGS IL

Show sample condition

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 273 K, pH 4.3

#	Name	Isotope labeling	Concentration
1	RodA	[U-98% 13C; U-98% 15N]	360 uM
2	H2O	natural abundance	90 %
3	D2O	natural abundance	10 %

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: -0.06 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: -0.06 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: -0.02 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: 0.28 ppm, Outliers: 1 Detail

Protein Blocks Logo

Calculated from 10 models in PDB: 6GCJ, Strand ID: A Detail

Release date

2014-02-09

Citation

1H, 13C and 15N resonance assignments of the RodA hydrophobin from the opportunistic pathogen Aspergillus fumigatus
Pille, A., Kwan, A., Cheung, I., Hampsey, M., Aimanianda, V., Delepierre, M., Latge, J., Sunde, M., Guijarro, J.
Biomol. NMR Assignments

Related entities 1. RodA, : 1 : 1 : 1 entities Detail

Experiments performed 12 experiments Detail

1 2D 1H-15N HSQC