MolNFT v1 · #184392 · protein
Nak C-di mutant with na+ and K+
7OOR · Potassium channel protein: “Nak C-di mutant with na+ and K+”. X-ray diffraction, 3 ligands (NA, K, CL), 2 pockets (best druggability 0.35). MolNFT v1 #184392 on GenesisL1: 3D structure, binding sites and pockets in GL1X.
- PDB
- 7OOR
- Type
- protein
- Length
- 186 residues
- Chains
- 2
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Potassium channel protein
- UniProt
- Q81HW2
- Ligands
- NA, K, CL
- Pockets
- 2 · best druggability 0.35
Structure
x-ray diffraction · 2 distinct chains · 77% helix, 0% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Potassium channel protein | protein | 92 | 77% helix, 0% strand | Q81HW2 |
| B | Potassium channel protein | protein | 94 | 78% helix, 0% strand | Q81HW2 |
Ligands and binding sites
- NA · Sodium ion · metal · 5 copies · chains A, B
- K · Potassium ion · metal · 2 copies · chains A, B
- CL · Chloride ion · ion · 2 copies · chains A, B
- MPD · (4S)-2-methyl-2,4-pentanediol · additive · 17 copies · chains A, B
- MRD · (4R)-2-methylpentane-2,4-diol · additive · 2 copies · chains A, B
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
2 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 51 | 0.35 | 0.78 | 10 | MRD |
| 2 | 54 | 0.25 | 0.72 | 14 | empty |
Interfaces
1 interface between chains.
- A–B · 1067 Ų buried · 6 hydrogen bonds · protein-protein
Compared structures
- 7OOR · NaK C-DI mutant with Na+ and K+ · the same entry in another collection · chain A against A, TM-score 1.00
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt Q81HW2
- Elsewhere: RCSB PDB 7OOR · PDBe 7OOR · UniProt Q81HW2
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