BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

BMRB Entry 27170

Title: Sequence specific 1H, 13C and 15N resonance assignments of a cataract-related variant G57W of human Gamma S-Crystallin   PubMed: 28936763

Deposition date: 2017-07-10 Original release date: 2017-08-04

Authors: Khandekar Bari, Jishan; Sharma, Shrikant; Chary, Kandala V.R.

Citation: Khandekar Bari, Jishan; Sharma, Shrikant; Chary, Kandala V.R.. "Sequence specific 1H, 13C and 15N resonance assignments of a cataract-related variant G57W of human Gamma S-Crystallin"  Biomol. NMR Assignments 12, 51-55 (2018).

Assembly members:
G57W_mutant_of_human_Gamma_S-Crystallin, polymer, 184 residues, Formula weight is not available

Natural source:   Common Name: E. coli   Taxonomy ID: 562   Superkingdom: Bacteria   Kingdom: not available   Genus/species: Escherichia coli

Experimental source:   Production method: recombinant technology   Host organism: Escherichia coli

Entity Sequences (FASTA):
G57W_mutant_of_human_Gamma_S-Crystallin: MSKTGTKITFYEDKNFQGRR YDCDCDCADFHTYLSRCNSI KVEGGTWAVYERPNFAWYMY ILPQGEYPEYQRWMGLNDRL SSCRAVHLPSGGQYKIQIFE KGDFSGQMYETTEDCPSIME QFHMREIHSCKVLEGVWIFY ELPNYRGRQYLLDKKEYRKP IDWGAASPAVQSFRRIVE

Data sets:
Data typeCount
13C chemical shifts630
15N chemical shifts177
1H chemical shifts1139

Additional metadata:

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

Assembly:

Entity Assembly IDEntity NameEntity ID
1Polypeptide chain1

Entities:

Entity 1, Polypeptide chain 184 residues - Formula weight is not available

1   METSERLYSTHRGLYTHRLYSILETHRPHE
2   TYRGLUASPLYSASNPHEGLNGLYARGARG
3   TYRASPCYSASPCYSASPCYSALAASPPHE
4   HISTHRTYRLEUSERARGCYSASNSERILE
5   LYSVALGLUGLYGLYTHRTRPALAVALTYR
6   GLUARGPROASNPHEALATRPTYRMETTYR
7   ILELEUPROGLNGLYGLUTYRPROGLUTYR
8   GLNARGTRPMETGLYLEUASNASPARGLEU
9   SERSERCYSARGALAVALHISLEUPROSER
10   GLYGLYGLNTYRLYSILEGLNILEPHEGLU
11   LYSGLYASPPHESERGLYGLNMETTYRGLU
12   THRTHRGLUASPCYSPROSERILEMETGLU
13   GLNPHEHISMETARGGLUILEHISSERCYS
14   LYSVALLEUGLUGLYVALTRPILEPHETYR
15   GLULEUPROASNTYRARGGLYARGGLNTYR
16   LEULEUASPLYSLYSGLUTYRARGLYSPRO
17   ILEASPTRPGLYALAALASERPROALAVAL
18   GLNSERPHEARGARGILEVALGLU

Samples:

sample_1: G57W mutant of human Gamma S-Crystallin, [U-100% 13C; U-100% 15N], 1.2 mM; sodium phosphate 25 mM

sample_conditions_1: ionic strength: 77 mM; pH: 7.4; pressure: 1 atm; temperature: 298 K

Experiments:

NameSampleSample stateSample conditions
2D 1H-15N HSQCsample_1isotropicsample_conditions_1
3D HNCOsample_1isotropicsample_conditions_1
3D HNCAsample_1isotropicsample_conditions_1
3D HNCACBsample_1isotropicsample_conditions_1
3D CBCA(CO)NHsample_1isotropicsample_conditions_1
3D H(CCO)NHsample_1isotropicsample_conditions_1
3D C(CO)NHsample_1isotropicsample_conditions_1
3D 15N-1H HSQC-NOESYsample_1isotropicsample_conditions_1

Software:

CARA, Keller and Wuthrich - chemical shift assignment

NMR spectrometers:

  • Bruker Ascend 700 MHz

Download simulated HSQC data in one of the following formats:
CSV: Backbone or all simulated shifts
SPARKY: Backbone or all simulated shifts