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Kcsa potassium channel mutant Y82C with cadmium bound

Analyse Kcsa potassium channel mutant Y82C with cadmium bound in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3STL
Type
protein
Length
534 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Antibody Fab fragment heavy chain; Antibody Fab fragment light chain; Voltage-gated…
UniProt
P0A334
Ligands
K, CD
Pockets
6 · best druggability 0.68

Structure

x-ray diffraction · 3 distinct chains · 19% helix, 41% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAntibody Fab fragment heavy chainprotein2195% helix, 49% strand—
BAntibody Fab fragment light chainprotein2126% helix, 53% strand—
CVoltage-gated potassium channelprotein10373% helix, 0% strandP0A334

Ligands and binding sites

  • K · Potassium ion · metal · 6 copies · chains C
  • CD · Cadmium ion · metal · chains C

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

6 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17130.680.7652empty
2800.540.8618empty
32160.510.7740empty
4670.500.8515empty
5550.440.8419empty

Interfaces

3 interfaces between chains.

  • A–B · 1854 Ų buried · 18 hydrogen bonds · protein-protein
  • A–C · 499 Ų buried · 7 hydrogen bonds · protein-protein
  • B–C · 438 Ų buried · 8 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 3STL · KcsA potassium channel mutant Y82C with Cadmium bound · the same entry in another collection · chain A against A, TM-score 1.00

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