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Inward rectifier potassium channel KIR2.2 in complex with dioctanoylglycerol pyrophosphate (dgpp)

Analyse Inward rectifier potassium channel KIR2.2 in complex with dioctanoylglycerol… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3SPC
Type
protein
Length
327 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Inward-rectifier K+ channel KIR2.2
UniProt
D2YW45
Ligands
P8P, K
Pockets
3 · best druggability 0.43

Structure

x-ray diffraction · 1 distinct chain · 33% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AInward-rectifier K+ channel KIR2.2protein32733% helix, 28% strandD2YW45

Ligands and binding sites

  • P8P · (2R)-3-{[(R)-hydroxy(phosphonooxy)phosphoryl]oxy}propane-1,2-diyl dioctanoate · ligand · chains A
  • K · Potassium ion · metal · 6 copies · chains A

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

Pockets

3 pockets found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11310.430.7625empty
2840.330.7423empty
3540.300.7513empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 3SPC · Inward rectifier potassium channel Kir2.2 in complex with dioctanoylglycerol… · the same entry in another collection · chain A against A, TM-score 1.00

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