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MolNFT v1 · #119482 · protein

GLUN1B-GLUN2B NMDA receptor in non-active-1 conformation

5FXH · N-methyl-D-aspartate receptor GLUN1: “GLUN1B-GLUN2B NMDA receptor in non-active-1 conformation”. Electron microscopy, 20 pockets (best druggability 0.85). MolNFT v1 #119482 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
5FXH
Type
protein
Length
3,077 residues
Chains
4
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
N-methyl-D-aspartate receptor GLUN1; N-methyl-D-aspartate receptor GLUN2B
UniProt
P35439, Q00960
Pockets
20 · best druggability 0.85

Structure

electron microscopy · 4 distinct chains · 39% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AN-methyl-D-aspartate receptor GLUN1protein78340% helix, 15% strandP35439
BN-methyl-D-aspartate receptor GLUN2Bprotein76339% helix, 15% strandQ00960
CN-methyl-D-aspartate receptor GLUN1protein77740% helix, 15% strandP35439
DN-methyl-D-aspartate receptor GLUN2Bprotein75438% helix, 15% strandQ00960

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18970.850.87137empty
28190.840.87146empty
36360.820.87127empty
46340.780.8487empty
54700.770.8673empty

Interfaces

4 interfaces between chains.

  • A–B · 1102 Ų buried · 0 hydrogen bonds · protein-protein
  • C–D · 1095 Ų buried · 0 hydrogen bonds · protein-protein
  • A–D · 818 Ų buried · 0 hydrogen bonds · protein-protein
  • B–C · 799 Ų buried · 0 hydrogen bonds · protein-protein

Compared structures

  • 5FXH · GluN1b-GluN2B NMDA receptor in non-active-1 conformation · the same entry in another collection · chain D against D, TM-score 1.00
  • Q00960 · AlphaFold monomer V2.0 prediction for glutamate receptor ionotropic, NMDA 2B (Q00960) · a predicted model of the same protein · chain D against A, TM-score 0.92
  • P35439 · AlphaFold monomer V2.0 prediction for glutamate receptor ionotropic, NMDA 1 (P35439) · a predicted model of the same protein · chain A against A, TM-score 0.90

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