BMRB Entry 27170
Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR27170
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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 Vector: pET28a
Entity Sequences (FASTA):
G57W_mutant_of_human_Gamma_S-Crystallin: MSKTGTKITFYEDKNFQGRR
YDCDCDCADFHTYLSRCNSI
KVEGGTWAVYERPNFAWYMY
ILPQGEYPEYQRWMGLNDRL
SSCRAVHLPSGGQYKIQIFE
KGDFSGQMYETTEDCPSIME
QFHMREIHSCKVLEGVWIFY
ELPNYRGRQYLLDKKEYRKP
IDWGAASPAVQSFRRIVE
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 630 |
| 15N chemical shifts | 177 |
| 1H chemical shifts | 1139 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | Polypeptide chain | 1 |
Entities:
Entity 1, Polypeptide chain 184 residues - Formula weight is not available
| 1 | MET | SER | LYS | THR | GLY | THR | LYS | ILE | THR | PHE | ||||
| 2 | TYR | GLU | ASP | LYS | ASN | PHE | GLN | GLY | ARG | ARG | ||||
| 3 | TYR | ASP | CYS | ASP | CYS | ASP | CYS | ALA | ASP | PHE | ||||
| 4 | HIS | THR | TYR | LEU | SER | ARG | CYS | ASN | SER | ILE | ||||
| 5 | LYS | VAL | GLU | GLY | GLY | THR | TRP | ALA | VAL | TYR | ||||
| 6 | GLU | ARG | PRO | ASN | PHE | ALA | TRP | TYR | MET | TYR | ||||
| 7 | ILE | LEU | PRO | GLN | GLY | GLU | TYR | PRO | GLU | TYR | ||||
| 8 | GLN | ARG | TRP | MET | GLY | LEU | ASN | ASP | ARG | LEU | ||||
| 9 | SER | SER | CYS | ARG | ALA | VAL | HIS | LEU | PRO | SER | ||||
| 10 | GLY | GLY | GLN | TYR | LYS | ILE | GLN | ILE | PHE | GLU | ||||
| 11 | LYS | GLY | ASP | PHE | SER | GLY | GLN | MET | TYR | GLU | ||||
| 12 | THR | THR | GLU | ASP | CYS | PRO | SER | ILE | MET | GLU | ||||
| 13 | GLN | PHE | HIS | MET | ARG | GLU | ILE | HIS | SER | CYS | ||||
| 14 | LYS | VAL | LEU | GLU | GLY | VAL | TRP | ILE | PHE | TYR | ||||
| 15 | GLU | LEU | PRO | ASN | TYR | ARG | GLY | ARG | GLN | TYR | ||||
| 16 | LEU | LEU | ASP | LYS | LYS | GLU | TYR | ARG | LYS | PRO | ||||
| 17 | ILE | ASP | TRP | GLY | ALA | ALA | SER | PRO | ALA | VAL | ||||
| 18 | GLN | SER | PHE | ARG | ARG | ILE | VAL | GLU |
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:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
| 3D HNCO | sample_1 | isotropic | sample_conditions_1 |
| 3D HNCA | sample_1 | isotropic | sample_conditions_1 |
| 3D HNCACB | sample_1 | isotropic | sample_conditions_1 |
| 3D CBCA(CO)NH | sample_1 | isotropic | sample_conditions_1 |
| 3D H(CCO)NH | sample_1 | isotropic | sample_conditions_1 |
| 3D C(CO)NH | sample_1 | isotropic | sample_conditions_1 |
| 3D 15N-1H HSQC-NOESY | sample_1 | isotropic | sample_conditions_1 |
Software:
CARA, Keller and Wuthrich - chemical shift assignment
NMR spectrometers:
- Bruker Ascend 700 MHz
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated shifts
SPARKY: Backbone
or all simulated shifts