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MolNFT v1 · #188169 · protein

Cryo-EM structure of GLUN1B-2B nmdar in complex with FAB5 in non- ACTIVE2-like conformation

7TET · Glutamate receptor ionotropic, NMDA 1: “Cryo-EM structure of GLUN1B-2B nmdar in complex with FAB5 in non- ACTIVE2-like conformation”. Electron microscopy, 20 pockets (best druggability 0.87). MolNFT v1 #188169 on GenesisL1: 3D…

PDB
7TET
Type
protein
Length
3,563 residues
Chains
8
Method
electron microscopy
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutamate receptor ionotropic, NMDA 1; Glutamate receptor ionotropic, NMDA 2B; FAB5 heavy…
UniProt
P35439, Q00960
Pockets
20 · best druggability 0.87

Structure

electron microscopy · 5 distinct chains · 33% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CGlutamate receptor ionotropic, NMDA 1protein78635% helix, 14% strandP35439
BGlutamate receptor ionotropic, NMDA 2Bprotein76937% helix, 14% strandQ00960
DGlutamate receptor ionotropic, NMDA 2Bprotein77037% helix, 14% strandQ00960
H, MFAB5 heavy chainprotein1143% helix, 54% strand—
L, NFAB5 light chainprotein1120% helix, 40% strand—

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110340.870.88148empty
25540.850.9169empty
33560.820.9163empty
45420.810.8768empty
52240.810.9442empty

Interfaces

14 interfaces between chains.

  • C–D · 3425 Ų buried · 23 hydrogen bonds · protein-protein
  • A–B · 3378 Ų buried · 22 hydrogen bonds · protein-protein
  • B–C · 2906 Ų buried · 23 hydrogen bonds · protein-protein
  • A–D · 2895 Ų buried · 24 hydrogen bonds · protein-protein
  • H–L · 903 Ų buried · 6 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 14 disulfide (disulfide).

Compared structures

  • 7TET · Cryo-EM structure of GluN1b-2B NMDAR in complex with Fab5 in non-active2-like conformation · the same entry in another collection · chain A against A, TM-score 1.00

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