BMRB Entry 18708
Chem Shift validation: AVS_full
BMRB Entry DOI: doi:10.13018/BMR18708
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Citation: Knight, Michael; Felli, Isabella; Pierattelli, Roberta; Bertini, Ivano; Emsley, Lyndon; Herrmann, Torsten; Pintacuda, Guido. "Rapid measurement of pseudocontact shifts in metalloproteins by proton-detected solid-state NMR spectroscopy." J. Am. Chem. Soc. 134, 14730-14733 (2012).
PubMed: 22916960
Assembly members:
SUPEROXIDE_DISMUTASE_CU-ZN, polymer, 153 residues, 15747.3145 Da.
entity_CO, non-polymer, 58.933 Da.
entity_CU, non-polymer, 63.546 Da.
Natural source: Common Name: Human Taxonomy ID: 9606 Superkingdom: Eukaryota Kingdom: Metazoa Genus/species: Homo sapiens
Experimental source: Production method: recombinant technology Host organism: Escherichia coli
Entity Sequences (FASTA):
SUPEROXIDE_DISMUTASE_CU-ZN: ATKAVAVLKGDGPVQGIINF
EQKESNGPVKVWGSIKGLTE
GLHGFHVHEFGDNTAGCTSA
GPHFNPLSRKHGGPKDEERH
VGDLGNVTADKDGVADVSIE
DSVISLSGDHSIIGRTLVVH
EKADDLGKGGNEESTKTGNA
GSRLACGVIGIAQ
- assigned_chemical_shifts
| Data type | Count |
| 13C chemical shifts | 245 |
| 15N chemical shifts | 136 |
| 1H chemical shifts | 136 |
Additional metadata:
Assembly:
| Entity Assembly ID | Entity Name | Entity ID |
|---|---|---|
| 1 | SUPEROXIDE DISMUTASE [CU-ZN] | 1 |
| 2 | COBALT (II) ION | 2 |
| 3 | COPPER (II) ION | 3 |
Entities:
Entity 1, SUPEROXIDE DISMUTASE [CU-ZN] 153 residues - 15747.3145 Da.
| 1 | ALA | THR | LYS | ALA | VAL | ALA | VAL | LEU | LYS | GLY | ||||
| 2 | ASP | GLY | PRO | VAL | GLN | GLY | ILE | ILE | ASN | PHE | ||||
| 3 | GLU | GLN | LYS | GLU | SER | ASN | GLY | PRO | VAL | LYS | ||||
| 4 | VAL | TRP | GLY | SER | ILE | LYS | GLY | LEU | THR | GLU | ||||
| 5 | GLY | LEU | HIS | GLY | PHE | HIS | VAL | HIS | GLU | PHE | ||||
| 6 | GLY | ASP | ASN | THR | ALA | GLY | CYS | THR | SER | ALA | ||||
| 7 | GLY | PRO | HIS | PHE | ASN | PRO | LEU | SER | ARG | LYS | ||||
| 8 | HIS | GLY | GLY | PRO | LYS | ASP | GLU | GLU | ARG | HIS | ||||
| 9 | VAL | GLY | ASP | LEU | GLY | ASN | VAL | THR | ALA | ASP | ||||
| 10 | LYS | ASP | GLY | VAL | ALA | ASP | VAL | SER | ILE | GLU | ||||
| 11 | ASP | SER | VAL | ILE | SER | LEU | SER | GLY | ASP | HIS | ||||
| 12 | SER | ILE | ILE | GLY | ARG | THR | LEU | VAL | VAL | HIS | ||||
| 13 | GLU | LYS | ALA | ASP | ASP | LEU | GLY | LYS | GLY | GLY | ||||
| 14 | ASN | GLU | GLU | SER | THR | LYS | THR | GLY | ASN | ALA | ||||
| 15 | GLY | SER | ARG | LEU | ALA | CYS | GLY | VAL | ILE | GLY | ||||
| 16 | ILE | ALA | GLN |
Entity 2, COBALT (II) ION - Co - 58.933 Da.
| 1 | CO |
Entity 3, COPPER (II) ION - Cu - 63.546 Da.
| 1 | CU |
Related Database Links:
| UNP | SODC_HUMAN |
| BMRB | 15711 15712 15713 15714 18509 18968 19962 26570 4202 |
| PDB | 1AZV 1BA9 1DSW 1FUN 1HL4 1HL5 1KMG 1L3N 1MFM 1N18 1N19 1OEZ 1OZT 1OZU 1P1V 1PTZ 1PU0 1RK7 1SOS 1SPD 1UXL 1UXM 2AF2 2C9S 2C9U 2C9V 2GBT 2GBU 2GBV 2LU5 2MP3 2NNX 2R27 2V0A 2VR6 2VR7 2VR8 2WKO 2WYT 2WYZ 2WZ0 2WZ5 2WZ6 2XJK 2ZKW 2ZKX 2ZKY 3CQP 3CQQ 3ECU 3ECV 3ECW 3GQF 3GZO 3GZP 3GZQ 3H2P 3H2Q 3K91 3KH3 3KH4 3QQD 3RE0 3T5W 4A7G 4A7Q 4A7S 4A7T 4A7U 4A7V 4B3E 4BCY 4FF9 4MCM 4MCN 4OH2 |
| DBJ | BAA14373 BAC20345 BAG35052 BAG73767 |
| EMBL | CAA26182 CAG29351 CAG46542 |
| GB | AAA72747 AAA80237 AAB05661 AAB05662 AAB27818 |
| REF | NP_000445 NP_001009025 XP_003813274 XP_004062735 XP_004062736 |
| SP | P00441 P60052 |
| AlphaFold | Q6NR85 P00441 P60052 |
Download HSQC peak lists in one of the following formats:
CSV: Backbone
or all simulated peaks
SPARKY: Backbone
or all simulated peaks