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MolNFT v1 · #119928 · protein

Structure of the mammalian voltage-gated calcium channel CAV1.1 complex at near atomic resolution

5GJV · Voltage-dependent L-type calcium channel subunit alpha-1S: “Structure of the mammalian voltage-gated calcium channel CAV1.1 complex at near atomic resolution”. Electron microscopy, 5 ligands (PC1, ETA, NAG), 20 pockets (best…

PDB
5GJV
Type
protein
Length
2,661 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Voltage-dependent L-type calcium channel subunit alpha-1S; Voltage-dependent L-type…
UniProt
P07293, P19517, P19518, P13806
Ligands
PC1, ETA, NAG, BMA, CA
Pockets
20 · best druggability 0.82

Structure

electron microscopy · 5 distinct chains · 48% helix, 11% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AVoltage-dependent L-type calcium channel subunit alpha-1Sprotein127663% helix, 2% strandP07293
BVoltage-dependent L-type calcium channel subunit beta-1protein10033% helix, 25% strandP19517
CVoltage-dependent L-type calcium channel subunit beta-1protein17848% helix, 16% strandP19517
EVoltage-dependent calcium channel gamma-1 subunitprotein16661% helix, 11% strandP19518
FVoltage-dependent calcium channel subunit alpha-2/DELTA-1protein94127% helix, 21% strandP13806

Ligands and binding sites

  • PC1 · 1,2-diacyl-sn-glycero-3-phosphocholine · ligand · 14 copies · chains A
  • ETA · Ethanolamine · ligand · chains F
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 23 copies · chains F, A
  • BMA · beta-D-mannopyranose · sugar · 2 copies · chains F
  • CA · Calcium ion · metal · 3 copies · chains A, F

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17670.820.8569empty
210320.810.82105empty
36670.810.8573empty
45800.800.8564PC1, CA
52310.770.9136empty

Interfaces

4 interfaces between chains.

  • A–F · 1858 Ų buried · 18 hydrogen bonds · protein-protein
  • A–E · 1603 Ų buried · 8 hydrogen bonds · protein-protein
  • A–C · 1035 Ų buried · 9 hydrogen bonds · protein-protein
  • B–C · 878 Ų buried · 13 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 15 glycan, 11 disulfide, 1 covalent (N-glycosylation, disulfide, covalent ligand).

Compared structures

  • 5GJV · Structure of the mammalian voltage-gated calcium channel Cav1.1 complex at near atomic… · the same entry in another collection · chain F against F, TM-score 1.00
  • P19517 · AlphaFold monomer V2.0 prediction for voltage-dependent L-type calcium channel subunit… · a predicted model of the same protein · chain C against A, TM-score 0.99
  • P13806 · AlphaFold monomer V2.0 prediction for voltage-dependent calcium channel subunit… · a predicted model of the same protein · chain F against A, TM-score 0.99
  • P07293 · AlphaFold monomer V2.0 prediction for voltage-dependent L-type calcium channel subunit… · a predicted model of the same protein · chain A against A, TM-score 0.97
  • P19518 · AlphaFold monomer V2.0 prediction for voltage-dependent calcium channel gamma-1 subunit… · a predicted model of the same protein · chain E against A, TM-score 0.91

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