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MolNFT v1 · #150380 · protein

Paired immunoglobulin-like receptor B (pirb) or leukocyte immunoglobulin-like receptor subfamily B member 3 (LILRB3) full extracellular domain

6GRT: “Paired immunoglobulin-like receptor B (pirb) or leukocyte immunoglobulin-like receptor subfamily B member 3…”. X-ray diffraction, 3 ligands (NAG, BMA, MAN), 11 pockets (best druggability 0.50). MolNFT v1 #150380 on GenesisL1: 3D…

PDB
6GRT
Type
protein
Length
1,187 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Paired immunoglobulin-like receptor B
UniProt
Q8K4V6
Ligands
NAG, BMA, MAN
Pockets
11 · best druggability 0.50

Structure

x-ray diffraction · 2 distinct chains · 2% helix, 47% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APaired immunoglobulin-like receptor Bprotein5932% helix, 48% strandQ8K4V6
BPaired immunoglobulin-like receptor Bprotein5942% helix, 46% strandQ8K4V6

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 6 copies · chains A, B
  • BMA · beta-D-mannopyranose · sugar · 2 copies
  • MAN · alpha-D-mannopyranose · sugar · 2 copies

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11390.500.7922empty
21760.450.7525empty
31160.430.7716empty
41270.420.7625empty
51220.410.7515empty

Interfaces

1 interface between chains.

  • A–B · 338 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 12 disulfide, 4 glycan (disulfide, N-glycosylation).

Compared structures

  • 6GRT · Paired immunoglobulin-like receptor B (PirB) or Leukocyte immunoglobulin-like receptor… · the same entry in another collection · chain A against A, TM-score 1.00

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