BMRB Entry 4422
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PDB ID:
Entry in NMR Restraints Grid
Validation report in NRG-CING
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR4422
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Title: NMR Solution Structure of Apis mellifera Chymotrypsin Inhibitor (AMCI).
Deposition date: 1999-09-27 Original release date: 2000-12-19
Authors: Cierpicki, T.; Otlewski, J.
Citation: Cierpicki, Tomasz; Bania, Jacek; Otlewski, Jacek. "NMR Solution Structure of Apis mellifera Chymotrypsin/Cathepsin G Inhibitor-1 (AMCI-1): Structural Similarity with Ascaris Protease Inhibitors." Protein Sci. 9, 976-984 (2000).
Assembly members:
Apis mellifera chymotrypsin inhibitor, polymer, 56 residues, Formula weight is not available
Natural source: Common Name: Honeybee Taxonomy ID: 7460 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Apis mellifera
Experimental source: Production method: purified from natural source
Entity Sequences (FASTA):
Apis mellifera chymotrypsin inhibitor: EECGPNEVFNTCGSACAPTC
AQPKTRICTMQCRIGCQCQE
GFLRNGEGACVLPENC
- assigned_chemical_shifts
| Data type | Count |
| 1H chemical shifts | 350 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | AMCI | 1 |
Entities:
Entity 1, AMCI 56 residues - Formula weight is not available
| 1 | GLU | GLU | CYS | GLY | PRO | ASN | GLU | VAL | PHE | ASN | ||||
| 2 | THR | CYS | GLY | SER | ALA | CYS | ALA | PRO | THR | CYS | ||||
| 3 | ALA | GLN | PRO | LYS | THR | ARG | ILE | CYS | THR | MET | ||||
| 4 | GLN | CYS | ARG | ILE | GLY | CYS | GLN | CYS | GLN | GLU | ||||
| 5 | GLY | PHE | LEU | ARG | ASN | GLY | GLU | GLY | ALA | CYS | ||||
| 6 | VAL | LEU | PRO | GLU | ASN | CYS |
Samples:
sample_one: Apis mellifera chymotrypsin inhibitor 6.6 mM
sample_conditions: pH*: 2.5 na; temperature: 288 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| NOESY | sample_one | not available | sample_conditions |
| TOCSY | sample_one | not available | sample_conditions |
| DQFCOSY | sample_one | not available | sample_conditions |
Software:
NMRPipe - spectra processing
SPARKY - analysis and intergation of NMR spectra
DYANA - structure calculation
NMR spectrometers:
- Varian UnityPlus 500 MHz