BMRB Entry 5452
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR5452
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Title: pKa determinations for AAPE PubMed: 12627950
Deposition date: 2002-07-04 Original release date: 2003-03-20
Authors: Song, Jikui; Laskowski, Michael; Qasim, Mohammad; Markley, John
Citation: Song, Jikui; Laskowski, Michael; Qasim, Mohammad; Markley, John. "NMR Determination of pKa Values for Asp, Glu, His, and Lys Mutants at Each Variable Contiguous Enzyme-inhibitor Contact Position of the Turkey Ovomucoid Third Domain" Biochemistry 42, 2847-2856 (2003).
Assembly members:
Suc-PPAD-pna, polymer, 4 residues, Formula weight is not available
Natural source: Common Name: not available Taxonomy ID: not available Superkingdom: not available Kingdom: not available Genus/species: not available not available
Experimental source: Production method: chemical synthesis
Entity Sequences (FASTA):
Suc-PPAD-pna: AAPE
- pKa_value_data_set
- pH_NMR_param_list
| Data type | Count |
| pKa values | 1 |
| pH NMR parameter values | 13 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | AAPE | 1 |
Entities:
Entity 1, AAPE 4 residues - Formula weight is not available
| 1 | ALA | ALA | PRO | GLU |
Samples:
sample_1: Suc-PPAD-pna 2 mM; KCl 100 mM; DSS 0.4 mM
conditions_set_1: pH: .; temperature: 298 K; ionic strength: 100 mM
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| TOCSY | sample_1 | not available | conditions_set_1 |
Software:
No software information available
NMR spectrometers:
- Bruker DMX 500 MHz