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MolNFT v1 · #160493 · protein

Cryoem structure of zebra fish alpha-1 glycine receptor bound with taurine in sma, super-open state

6PM0 · Glycine receptor subunit ALPHAZ1: “Cryoem structure of zebra fish alpha-1 glycine receptor bound with taurine in sma, super-open state”. Electron microscopy, 3 ligands (TAU, NAG, BMA), 20 pockets (best druggability 0.75). MolNFT v1…

PDB
6PM0
Type
protein
Length
1,730 residues
Chains
5
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glycine receptor subunit ALPHAZ1
UniProt
O93430
Ligands
TAU, NAG, BMA
Pockets
20 · best druggability 0.75

Structure

electron microscopy · 1 distinct chain · 36% helix, 28% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, D, EGlycine receptor subunit ALPHAZ1protein34636% helix, 28% strandO93430

Ligands and binding sites

  • TAU · 2-aminoethanesulfonic acid · ligand · 5 copies · chains A, B, C, D, E
  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 10 copies · chains A, B, C, D, E
  • BMA · beta-D-mannopyranose · sugar · 5 copies

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

Pockets

20 pockets found on a 1 Å grid, 17 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111130.750.7756empty
24600.710.8157empty
34530.710.8249empty
45710.710.8075empty
54400.710.8146empty

Interfaces

5 interfaces between chains.

  • A–E · 2105 Ų buried · 18 hydrogen bonds · protein-protein
  • A–B · 2092 Ų buried · 16 hydrogen bonds · protein-protein
  • D–E · 2090 Ų buried · 17 hydrogen bonds · protein-protein
  • B–C · 2077 Ų buried · 16 hydrogen bonds · protein-protein
  • C–D · 2069 Ų buried · 16 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 10 disulfide, 5 glycan (disulfide, N-glycosylation).

Compared structures

  • 6PM0 · CryoEM structure of zebra fish alpha-1 glycine receptor bound with Taurine in SMA… · the same entry in another collection · chain E against E, TM-score 1.00
  • O93430 · AlphaFold monomer V2.0 prediction for glycine receptor subunit ALPHAZ1 (O93430) · a predicted model of the same protein · chain C against A, TM-score 0.96

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