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MolNFT v1 · #180951 · protein

Cryo-EM structure of human cgmp-bound open CNGA1 channel in K+/CA2+

7LFW · Cgmp-gated cation channel alpha-1: “Cryo-EM structure of human cgmp-bound open CNGA1 channel in K+/CA2+”. Electron microscopy, 2 ligands (PCG, CA), 20 pockets (best druggability 0.85). MolNFT v1 #180951 on GenesisL1: 3D structure…

PDB
7LFW
Type
protein
Length
1,800 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Cgmp-gated cation channel alpha-1
UniProt
P29973
Ligands
PCG, CA
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 1 distinct chain · 59% helix, 10% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DCgmp-gated cation channel alpha-1protein45059% helix, 10% strandP29973

Ligands and binding sites

  • PCG · Cyclic guanosine monophosphate · ligand · 4 copies · chains A, B, C, D
  • CA · Calcium ion · metal · 2 copies · 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, 20 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19140.850.8784CA
28380.740.7864empty
38630.740.7873empty
48940.730.7774empty
58560.730.7872empty

Interfaces

6 interfaces between chains.

  • A–B · 2818 Ų buried · 35 hydrogen bonds · protein-protein
  • B–C · 2807 Ų buried · 35 hydrogen bonds · protein-protein
  • A–D · 2804 Ų buried · 35 hydrogen bonds · protein-protein
  • C–D · 2804 Ų buried · 35 hydrogen bonds · protein-protein
  • A–C · 34 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 7LFW · Cryo-EM structure of human cGMP-bound open CNGA1 channel in K+/Ca2+ · the same entry in another collection · chain D against D, TM-score 1.00
  • P29973 · AlphaFold monomer V2.0 prediction for cgmp-gated cation channel alpha-1 (P29973) · a predicted model of the same protein · chain C against A, TM-score 0.94

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