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Cryoem structure of human polycystin-2/PKD2 in udm supplemented with PI(3,5)P2

Analyse Cryoem structure of human polycystin-2/PKD2 in udm supplemented with PI(3,5)P2 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6T9O
Type
protein
Length
1,924 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Polycystin-2
UniProt
Q13563
Ligands
UMQ, CLR, NAG, CA
Pockets
20 · best druggability 0.84

Structure

electron microscopy · 1 distinct chain · 54% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DPolycystin-2protein48154% helix, 10% strandQ13563

Ligands and binding sites

  • UMQ · Undecyl-maltoside · ligand · 20 copies · chains A, B, C, D
  • CLR · Cholesterol · ligand · 4 copies · chains A, B, C, D
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 16 copies · chains A, B, C, D
  • CA · Calcium ion · metal · chains A, B, C, D

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

Pockets

20 pockets found on a 1 Å grid, 14 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110550.840.84129UMQ
211160.830.84140UMQ
310880.830.84119UMQ
410720.830.83118UMQ
51470.820.9824CA

Interfaces

6 interfaces between chains.

  • A–D · 3613 Ų buried · 20 hydrogen bonds · protein-protein
  • A–B · 3613 Ų buried · 20 hydrogen bonds · protein-protein
  • B–C · 3607 Ų buried · 19 hydrogen bonds · protein-protein
  • C–D · 3606 Ų buried · 19 hydrogen bonds · protein-protein
  • B–D · 49 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 glycan, 4 disulfide (N-glycosylation, disulfide).

Compared structures

  • 6T9O · CryoEM structure of human polycystin-2/PKD2 in UDM supplemented with PI(3,5)P2 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q13563 · AlphaFold monomer V2.0 prediction for polycystin-2 (Q13563) · a predicted model of the same protein · chain A against A, TM-score 0.98

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