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Crystal structure of GLUN1B-2B atd complexed to FAB5 anti-GLUN2B antibody

Analyse Crystal structure of GLUN1B-2B atd complexed to FAB5 anti-GLUN2B antibody in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
7TE6
Type
protein
Length
2,206 residues
Chains
8
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Glutamate receptor ionotropic, NMDA 1; Glutamate receptor ionotropic, NMDA 2B; FAB5 heavy…
UniProt
A0A1L8F5J9, Q00960
Pockets
20 · best druggability 0.83

Structure

x-ray diffraction · 7 distinct chains · 25% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGlutamate receptor ionotropic, NMDA 1protein34636% helix, 23% strandA0A1L8F5J9
BGlutamate receptor ionotropic, NMDA 2Bprotein32933% helix, 23% strandQ00960
CFAB5 heavy chainprotein2154% helix, 49% strand—
D, HFAB5 light chainprotein2153% helix, 51% strand—
EGlutamate receptor ionotropic, NMDA 1protein34537% helix, 24% strandA0A1L8F5J9
FGlutamate receptor ionotropic, NMDA 2Bprotein32734% helix, 23% strandQ00960
GFAB5 heavy chainprotein2144% helix, 51% strand—

Pockets

20 pockets found on a 1 Å grid, 13 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19540.830.84122empty
24690.750.8348empty
310490.740.7790empty
4640.720.9823empty
54170.700.8144empty

Interfaces

18 interfaces between chains.

  • C–D · 1957 Ų buried · 13 hydrogen bonds · protein-protein
  • G–H · 1955 Ų buried · 17 hydrogen bonds · protein-protein
  • E–F · 1441 Ų buried · 10 hydrogen bonds · protein-protein
  • A–B · 1306 Ų buried · 6 hydrogen bonds · protein-protein
  • D–H · 1103 Ų buried · 12 hydrogen bonds · protein-protein

Compared structures

  • 7TE6 · Crystal structure of GluN1b-2B ATD complexed to Fab5 anti-GluN2B antibody · the same entry in another collection · chain A against A, TM-score 1.00

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