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MolNFT v1 · #50236 · protein

Crystal structure of the NR3B ligand binding core complex with D- serine at 1.62 ångström resolution

2RCB · Glutamate [NMDA] receptor subunit 3B: “Crystal structure of the NR3B ligand binding core complex with D- serine at 1.62 ångström resolution”. X-ray diffraction, 1 ligand (DSN), 2 pockets (best druggability 0.78). MolNFT v1 #50236 on…

PDB
2RCB
Type
protein
Length
564 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutamate [NMDA] receptor subunit 3B
UniProt
Q8VHN2
Ligands
DSN
Pockets
2 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BGlutamate [NMDA] receptor subunit 3Bprotein28236% helix, 26% strandQ8VHN2

Ligands and binding sites

  • DSN · D-serine · ligand · 2 copies · chains A, B
  • GOL · Glycerol · additive · chains A

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

Pockets

2 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111560.780.80115empty
21810.600.8331empty

Interfaces

1 interface between chains.

  • A–B · 861 Ų buried · 14 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 2RCB · Crystal structure of the NR3B ligand binding core complex with D-serine at 1.62 Angstrom… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q8VHN2 · AlphaFold monomer V2.0 prediction for glutamate receptor ionotropic, NMDA 3B (Q8VHN2) · a predicted model of the same protein · chain B against A, TM-score 0.99

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