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1H, 13C and 15N Chemical Shift Assignments for Urea-denatured G88W-110 Fragment of Staphylococcal Nuclease
Authors
Ye, K., Wang, J.
Assembly
G88W110 fragment of staphylococcal nuclease
Entity
1. G88W110 fragment of staphylococcal nuclease (polymer, Thiol state: not present), 110 monomers, 12430.36 Da Detail

ATSTKKLHKE PATLIKAIDG DTVKLMYKGQ PMTFRLLLVD TPETKHPKKG VEKYGPEASA FTKKMVENAK KIEVEFDKGQ RTDKYGRWLA YIYADGKMVN EALVRQGLAK


Formula weight
12430.36 Da
Source organism
Staphylococcus aureus
Exptl. method
NMR
Data set
assigned_chemical_shifts
Chem. Shift Complete
Sequence coverage: 100.0 %, Completeness: 79.5 %, Completeness (bb): 99.7 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All79.5 % (1061 of 1334)84.7 % (593 of 700)70.1 % (364 of 519)90.4 % (104 of 115)
Backbone99.7 % (640 of 642)99.5 % (214 of 215)100.0 % (322 of 322)99.0 % (104 of 105)
Sidechain65.9 % (523 of 794)78.1 % (379 of 485)48.2 % (144 of 299) 0.0 % (0 of 10)
Aromatic 0.0 % (0 of 90) 0.0 % (0 of 45) 0.0 % (0 of 44) 0.0 % (0 of 1)
Methyl76.3 % (90 of 118)98.3 % (58 of 59)54.2 % (32 of 59)

1. Staphylococcal Nuclease

ATSTKKLHKE PATLIKAIDG DTVKLMYKGQ PMTFRLLLVD TPETKHPKKG VEKYGPEASA FTKKMVENAK KIEVEFDKGQ RTDKYGRWLA YIYADGKMVN EALVRQGLAK

Sample

Temperature 305 (±0.1) K, pH 4.9 (±0.1)


#NameIsotope labelingTypeConcentration
1Staphylococcal Nuclease[U-95% 13C; U-90% 15N]2.5 mM
2acetate buffer[U-99% 2H]50 mM
3Urea6 M
4H2O90 %
5D2O10 %

LACS Plot; CA
Referencing offset: -0.12 ppm, Outliers: 1 Detail
LACS Plot; CB
Referencing offset: -0.12 ppm, Outliers: 1 Detail
LACS Plot; HA
Referencing offset: 0.03 ppm, Outliers: 2 Detail
LACS Plot; CO
Referencing offset: 0.22 ppm, Outliers: 1 Detail
Release date
2001-08-07
Citation
Self-association reaction of denatured staphylococcal nuclease fragments characterized by heteronuclear NMR
Ye, K., Wang, J.
J. Mol. Biol. (2001), 307, 309-322, PubMed 11243822 , DOI 10.1006/jmbi.2000.4449 ,
Related entities 1. G88W110 fragment of staphylococcal nuclease, : 1 : 75 : 39 entities Detail
Experiments performed 10 experiments Detail
Keywords Denatured Protein, Self-association, Staphylococcal Nuclease