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calcium channel-ligand

Analyse calcium channel-ligand in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6KZP
Type
protein
Length
1,014 residues
Chains
1
Method
electron microscopy
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
3.1
Source
Homo sapiens
Molecule
Voltage-dependent T-type calcium channel subunit alpha-1G,Voltage-dependent T-type…
UniProt
O43497
Ligands
3PE, Y01, DZR, NAG, CA
Pockets
19 · best druggability 0.84

Structure

electron microscopy · resolution 3.1 · 1 distinct chain · 71% helix, 2% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AVoltage-dependent T-type calcium channel subunit alpha-1G,Voltage-dependent T-type calcium channel subunit alpha-1Gprotein101471% helix, 2% strandO43497

Ligands and binding sites

  • 3PE · 1,2-diacyl-sn-glycero-3-phosphoethanolamine · ligand · 8 copies · chains A
  • Y01 · Cholesterol hemisuccinate · ligand · 3 copies · chains A
  • DZR · ~{N}-[[1-[2-(~{tert}-butylamino)-2-oxidanylidene-ethyl]piperidin-4-yl]methyl]-3-chloranyl-5-fluoranyl-benzamide · ligand · chains A
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 4 copies · chains A
  • CA · Calcium ion · metal · 2 copies · chains A

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

Pockets

19 pockets found on a 1 Å grid, 10 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111330.840.8583CA, DZR, 3PE
26960.670.7670empty
33310.670.8140empty
42880.640.8130empty
52840.600.78313PE

Modifications

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

Compared structures

  • 6KZP · Calcium channel-ligand · the same entry in another collection · chain A against A, TM-score 1.00
  • O43497 · AlphaFold monomer V2.0 prediction for voltage-dependent T-type calcium channel subunit… · a predicted model of the same protein · chain A against A, TM-score 0.99

Analyse

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