BMRB Entry 53288

Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR53288

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Title:
Backbone 1H, 13C, and 15N Chemical Shift Assignments for sMyBP-C LKR-mutant M-domain
Deposition date:
2025-07-20
Original release date:
2026-05-04
Authors:
Iyer, Aishwarya
Citation:

Citation: Iyer, Aishwarya; Wright, Nathan; Cook, Mary; Takagi, Yasuharu; Johnson, Bruce; Biancalana, Valerie; Massier, Marie; Spodenkiewicz, Marta; Poirsier, Celine; Vallecillo, Brice; Boyer, Francois; Pineau, Charlotte; Hensley, Lindsey; Sellers, James; Varney, Kristen; Weber, David; Kontrogianni-Konstantopoulos, Aikaterini. "Structural and biochemical alterations in the MYBPC1 M-domain underlie Myotrem pathogenicity"  PNAS ., .-..

Assembly members:

Assembly members:
entity_1, polymer, 106 residues, Formula weight is not available

Natural source:

Natural source:   Common Name: Human   Taxonomy ID: 9606   Superkingdom: Eukaryota   Kingdom: Metazoa   Genus/species: Homo sapiens

Experimental source:

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli   Vector: pET-11a

Entity Sequences (FASTA):

Entity Sequences (FASTA):
entity_1: MHHHHHHESTGTTPNIDIRS AFKRSGEGQEDAGELDFSGL LKRREVKQQEEEPQVDVWEL LKNAKPSEYEKIAFQYGITD LRGMLKRLKRLKRMRREEKK SAAFAK

Data sets:
Data typeCount
13C chemical shifts399
15N chemical shifts96
1H chemical shifts456

Additional metadata:

  • Assembly
  • Samples and Experiments
  • Software
  • Spectrometers
  • Hide all

Assembly:

Entity Assembly IDEntity NameEntity ID
1M-domain LKR-mutant1

Entities:

Entity 1, M-domain LKR-mutant 106 residues - Formula weight is not available

1   METHISHISHISHISHISHISGLUSERTHR
2   GLYTHRTHRPROASNILEASPILEARGSER
3   ALAPHELYSARGSERGLYGLUGLYGLNGLU
4   ASPALAGLYGLULEUASPPHESERGLYLEU
5   LEULYSARGARGGLUVALLYSGLNGLNGLU
6   GLUGLUPROGLNVALASPVALTRPGLULEU
7   LEULYSASNALALYSPROSERGLUTYRGLU
8   LYSILEALAPHEGLNTYRGLYILETHRASP
9   LEUARGGLYMETLEULYSARGLEULYSARG
10   LEULYSARGMETARGARGGLUGLULYSLYS
11   SERALAALAPHEALALYS

Samples:

sample_1: M-domain LKR-mutant, [U-13C; U-15N], 0.5 mM; HEPES 20 mM; NaCl 50 mM; TCEP 1 mM; sodium azide 0.01%; D2O 10%

sample_conditions_1: ionic strength: 0.05 M; pH: 7.0; pressure: 1 atm; temperature: 298 K

Experiments:

NameSampleSample stateSample conditions
2D 1H-15N HSQCsample_1isotropicsample_conditions_1
3D HNCAsample_1isotropicsample_conditions_1
3D HN(CO)CAsample_1isotropicsample_conditions_1
3D HNCACBsample_1isotropicsample_conditions_1
3D CBCA(CO)NHsample_1isotropicsample_conditions_1
3D HNCOsample_1isotropicsample_conditions_1
3D HN(CA)COsample_1isotropicsample_conditions_1
3D H(CCO)NHsample_1isotropicsample_conditions_1
3D C(CO)NHsample_1isotropicsample_conditions_1

Software:

NMRPipe - processing

CcpNMR v3.0.4 - chemical shift assignment

NMR spectrometers:

  • Bruker AVANCE III 600 MHz

Download HSQC peak lists in one of the following formats:
CSV: Backbone or all simulated peaks
SPARKY: Backbone or all simulated peaks