BMRB Entry 7107
Chem Shift validation: AVS_full, LACS
BMRB Entry DOI: doi:10.13018/BMR7107
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NMR-STAR v3 text file.
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Citation: McDonnell, Patricia; Constantine, K.; Goldfarb, V.; Johnson, S.; Sulsky, R.; Magnin, D.; Robl, J.; Caulfield, T.; Parker, R.; Taylor, D.; Adam, L.; Metzler, W.; Mueller, L.; Farmer, B.. "1H,13C and 15N assigned chemical shifts for human keratinocyte fatty acid-binding protein with a small molecule inhibitor (BMS-480404)" J. Med. Chem. 49, 5013-5017 (2006).
PubMed: 16884313
Assembly members:
human keratinocyte fatty-acid binding protein, polymer, 135 residues, Formula weight is not available
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: recombinant technology
Entity Sequences (FASTA):
human keratinocyte fatty-acid binding protein: MATVQQLEGRWRLVDSKGFD
EYMKELGVGIALRKMGAMAK
PDCIITCDGKNLTIKTESTL
KTTQFSCTLGEKFEETTADG
RKTQTVCNFTDGALVQHQEW
DGKESTITRKLKDGKLVVEC
VMNNVTCTRIYEKVE
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 524 |
| 15N chemical shifts | 134 |
| 1H chemical shifts | 870 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | kFABP | 1 |
Entities:
Entity 1, kFABP 135 residues - Formula weight is not available
| 1 | MET | ALA | THR | VAL | GLN | GLN | LEU | GLU | GLY | ARG | ||||
| 2 | TRP | ARG | LEU | VAL | ASP | SER | LYS | GLY | PHE | ASP | ||||
| 3 | GLU | TYR | MET | LYS | GLU | LEU | GLY | VAL | GLY | ILE | ||||
| 4 | ALA | LEU | ARG | LYS | MET | GLY | ALA | MET | ALA | LYS | ||||
| 5 | PRO | ASP | CYS | ILE | ILE | THR | CYS | ASP | GLY | LYS | ||||
| 6 | ASN | LEU | THR | ILE | LYS | THR | GLU | SER | THR | LEU | ||||
| 7 | LYS | THR | THR | GLN | PHE | SER | CYS | THR | LEU | GLY | ||||
| 8 | GLU | LYS | PHE | GLU | GLU | THR | THR | ALA | ASP | GLY | ||||
| 9 | ARG | LYS | THR | GLN | THR | VAL | CYS | ASN | PHE | THR | ||||
| 10 | ASP | GLY | ALA | LEU | VAL | GLN | HIS | GLN | GLU | TRP | ||||
| 11 | ASP | GLY | LYS | GLU | SER | THR | ILE | THR | ARG | LYS | ||||
| 12 | LEU | LYS | ASP | GLY | LYS | LEU | VAL | VAL | GLU | CYS | ||||
| 13 | VAL | MET | ASN | ASN | VAL | THR | CYS | THR | ARG | ILE | ||||
| 14 | TYR | GLU | LYS | VAL | GLU |
Samples:
sample_1: human keratinocyte fatty-acid binding protein, [U-13C; U-15N], 1.4 mM; BMS4 mM
conditions_1: pH: 7.5; temperature: 293 K
Experiments:
| Name | Sample | Sample state | Sample conditions |
|---|---|---|---|
| 3D HNCO | sample_1 | not available | conditions_1 |
| HNCA | sample_1 | not available | conditions_1 |
| HNCAHA | sample_1 | not available | conditions_1 |
| HNCB | sample_1 | not available | conditions_1 |
| HNHB | sample_1 | not available | conditions_1 |
| HBHACONH | sample_1 | not available | conditions_1 |
| CBCACONH | sample_1 | not available | conditions_1 |
| HCCH-TOCSY | sample_1 | not available | conditions_1 |
| 4D(CN)NOE | sample_1 | not available | conditions_1 |
| 4D(CC)NOE | sample_1 | not available | conditions_1 |
| CH-HCQC | sample_1 | not available | conditions_1 |
| 3D 13C edited 13C/15N filtered HSQC-NOESY | sample_1 | not available | conditions_1 |
| 2D F1 | sample_1 | not available | conditions_1 |
| F2-13C/15N filtered NOE | sample_1 | not available | conditions_1 |
| 2D 13C/15N double reverse filtered TOCSY | sample_1 | not available | conditions_1 |
Software:
No software information available
NMR spectrometers:
- Varian Inova 597.76 MHz
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks