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MolNFT v1 · #190144 · protein

Architecture of the human nalcn channelosome

7WJI · Protein unc-80 homolog: “Architecture of the human nalcn channelosome”. Electron microscopy, 20 pockets (best druggability 0.89). MolNFT v1 #190144 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7WJI
Type
protein
Length
5,128 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein unc-80 homolog; Protein unc-79 homolog; Calmodulin-1; Sodium leak channel…
UniProt
Q8N2C7, Q9P2D8, P0DP23, Q8IZF0, B1AL88
Pockets
20 · best druggability 0.89

Structure

electron microscopy · 5 distinct chains · 57% helix, 1% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein unc-80 homologprotein176360% helix, 2% strandQ8N2C7
BProtein unc-79 homologprotein166357% helix, 1% strandQ9P2D8
ECalmodulin-1protein12656% helix, 3% strandP0DP23
CSodium leak channel non-selective PROTEIN,EXTENDED tegument protein PP150protein139458% helix, 1% strandQ8IZF0
DTransmembrane protein FAM155Aprotein18234% helix, 3% strandB1AL88

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17590.890.92119empty
25720.880.9394empty
311540.870.88103empty
47130.870.9085empty
58150.830.8578empty

Interfaces

6 interfaces between chains.

  • A–B · 5412 Ų buried · 30 hydrogen bonds · protein-protein
  • C–D · 2378 Ų buried · 16 hydrogen bonds · protein-protein
  • A–C · 2175 Ų buried · 9 hydrogen bonds · protein-protein
  • E–C · 1414 Ų buried · 7 hydrogen bonds · protein-protein
  • A–E · 332 Ų buried · 1 hydrogen bond · protein-protein

Compared structures

  • 7WJI · Architecture of the human NALCN channelosome · the same entry in another collection · chain D against D, TM-score 1.00
  • Q8IZF0 · AlphaFold monomer V2.0 prediction for sodium leak channel non- selective protein (Q8IZF0) · a predicted model of the same protein · chain C against A, TM-score 0.94
  • B1AL88 · AlphaFold monomer V2.0 prediction for transmembrane protein FAM155A (B1AL88) · a predicted model of the same protein · chain D against A, TM-score 0.78
  • P0DP23 · AlphaFold monomer V2.0 prediction for calmodulin-1 (P0DP23) · a predicted model of the same protein · chain E against A, TM-score 0.46
  • Q9P2D8 · AlphaFold monomer V2.0 prediction for protein unc-79 homolog (Q9P2D8) · a predicted model of the same protein · chain B against A, TM-score 0.44

Analyse

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