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Structure of SUR1 subunit bound with repaglinide

Analyse Structure of SUR1 subunit bound with repaglinide in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6JB3
Type
protein
Length
671 residues
Chains
1
Method
electron microscopy
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.53
Source
Mesocricetus auratus
Molecule
ATP-binding cassette sub-family C member 8 isoform X2
UniProt
A0A1U7R319
Ligands
BJX, AJP
Pockets
7 · best druggability 0.84

Structure

electron microscopy · resolution 3.53 · 1 distinct chain · 88% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
BATP-binding cassette sub-family C member 8 isoform X2protein67188% helix, 0% strandA0A1U7R319

Ligands and binding sites

  • BJX · Repaglinide · ligand · chains B
  • AJP · Digitonin · ligand · chains B

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

Pockets

7 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18590.840.8689BJX, AJP
21880.530.7829empty
31270.500.8028empty
41260.450.7724empty
5980.430.7815empty

Compared structures

  • 6JB3 · Structure of SUR1 subunit bound with repaglinide · the same entry in another collection · chain B against B, TM-score 1.00

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