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1H, 13C, and 15N Chemical Shift Assignments for G88W110 fragment of Staphylococcal Nuclease
Authors
Liu, D., Ye, K., Feng, Y., 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
Refine. method
simulated annealing
Data set
assigned_chemical_shifts
Chem. Shift Complete
Sequence coverage: 100.0 %, Completeness: 80.7 %, Completeness (bb): 98.1 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All80.7 % (1076 of 1334)72.0 % (504 of 700)89.2 % (463 of 519)94.8 % (109 of 115)
Backbone98.1 % (630 of 642)97.2 % (209 of 215)98.8 % (318 of 322)98.1 % (103 of 105)
Sidechain68.9 % (547 of 794)60.8 % (295 of 485)82.3 % (246 of 299)60.0 % (6 of 10)
Aromatic37.8 % (34 of 90)64.4 % (29 of 45) 9.1 % (4 of 44)100.0 % (1 of 1)
Methyl100.0 % (118 of 118)100.0 % (59 of 59)100.0 % (59 of 59)

1. Staphylococcal nuclease

ATSTKKLHKE PATLIKAIDG DTVKLMYKGQ PMTFRLLLVD TPETKHPKKG VEKYGPEASA FTKKMVENAK KIEVEFDKGQ RTDKYGRWLA YIYADGKMVN EALVRQGLAK

Sample

Temperature 305 (±1) K, pH 4.9 (±0.2)


#NameIsotope labelingTypeConcentration
1Staphylococcal nuclease[U-95% 13C; U-90% 15N]2.0 ~ 2.5 mM

LACS Plot; CA
Referencing offset: 0.01 ppm, Outliers: 1 Detail
LACS Plot; CB
Referencing offset: 0.01 ppm, Outliers: 1 Detail
LACS Plot; HA
Referencing offset: -0.03 ppm, Outliers: 1 Detail
LACS Plot; CO
Referencing offset: 0.2 ppm, Outliers: 1 Detail
Protein Blocks Logo
Calculated from 12 models in PDB: 1RKN, Strand ID: A Detail


Release date
2003-12-07
Citation 1
Folding stability and cooperativity of the three forms of 1-110 residues fragment of staphylococcal nuclease
Xie, T., Liu, D., Feng, Y., Shan, L., Wang, J.
Biophys. J. (2007), 92, 2090-2107, PubMed 17172296 , DOI 10.1529/biophysj.106.092155 ,
Citation 2
Native-like partially folded conformations and folding process revealed in the N-terminal large fragments of staphylococcal nuclease: a study by NMR spectroscopy
Feng, Y., Liu, D., Wang, J.
J. Mol. Biol. (2003), 330, 821-837, PubMed 12850150 , DOI 10.1016/s0022-2836(03)00660-0 ,
Related entities 1. G88W110 fragment of Staphylococcal Nuclease, : 1 : 75 : 39 entities Detail