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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_anomalous, AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR36085
MolProbity Validation Chart
NMR-STAR file interactive viewer.
NMR-STAR v3 text file.
XML gzip file.
RDF gzip file.
All files associated with the entry
Citation: Kim, I.; Jeong, M.; Ka, D.; Han, M.; Kim, N.; Bae, E.; Suh, J.. "Solution structure and dynamics of anti-CRISPR AcrIIA4, the Cas9 inhibitor." Sci. Rep. 8, 3883-3883 (2018).
PubMed: 29497118
Assembly members:
Anti-CRISPR AcrIIA4, polymer, 87 residues, 10182.073 Da.
Natural source: Common Name: Listeria monocytogenes Taxonomy ID: 1639 Superkingdom: Bacteria Kingdom: not available Genus/species: Listeria monocytogenes
Experimental source: Production method: recombinant technology Host organism: Escherichia coli
Entity Sequences (FASTA):
Anti-CRISPR AcrIIA4: MNINDLIREIKNKDYTVKLS
GTDSNSITQLIIRVNNDGNE
YVISESENESIVEKFISAFK
NGWNQEYEDEEEFYNDMQTI
TLKSELN
Data type | Count |
13C chemical shifts | 360 |
15N chemical shifts | 97 |
1H chemical shifts | 589 |
Entity Assembly ID | Entity Name | Entity ID |
---|---|---|
1 | entity_1 | 1 |
Entity 1, entity_1 87 residues - 10182.073 Da.
1 | MET | ASN | ILE | ASN | ASP | LEU | ILE | ARG | GLU | ILE | ||||
2 | LYS | ASN | LYS | ASP | TYR | THR | VAL | LYS | LEU | SER | ||||
3 | GLY | THR | ASP | SER | ASN | SER | ILE | THR | GLN | LEU | ||||
4 | ILE | ILE | ARG | VAL | ASN | ASN | ASP | GLY | ASN | GLU | ||||
5 | TYR | VAL | ILE | SER | GLU | SER | GLU | ASN | GLU | SER | ||||
6 | ILE | VAL | GLU | LYS | PHE | ILE | SER | ALA | PHE | LYS | ||||
7 | ASN | GLY | TRP | ASN | GLN | GLU | TYR | GLU | ASP | GLU | ||||
8 | GLU | GLU | PHE | TYR | ASN | ASP | MET | GLN | THR | ILE | ||||
9 | THR | LEU | LYS | SER | GLU | LEU | ASN |
sample_1: AcrIIA4, [U-99% 13C; U-99% 15N], 2.0 mM; Tris HCl 20 mM; NaCl 100 mM; H2O 90%; D2O, [U-2H], 10%
sample_conditions_1: ionic strength: 100 mM; pH: 7.4; pressure: 1 atm; temperature: 298 K
Name | Sample | Sample state | Sample conditions |
---|---|---|---|
2D 1H-15N HSQC | sample_1 | isotropic | sample_conditions_1 |
3D CBCA(CO)NH | sample_1 | isotropic | sample_conditions_1 |
3D HNCACB | sample_1 | isotropic | sample_conditions_1 |
3D HBHA(CO)NH | sample_1 | isotropic | sample_conditions_1 |
3D HNCO | sample_1 | isotropic | sample_conditions_1 |
3D 1H-13C NOESY | sample_1 | isotropic | sample_conditions_1 |
3D 1H-13C NOESY aromatic | sample_1 | isotropic | sample_conditions_1 |
3D 1H-15N NOESY | sample_1 | isotropic | sample_conditions_1 |
PIPP, Garrett - chemical shift assignment
X-PLOR NIH, Schwieters, Kuszewski, Tjandra and Clore - structure calculation
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks