GL1X · GenesisL1 explorer

MolNFT v1 · #58782 · protein

Human CD94/NKG2A

3BDW · Natural killer cells antigen CD94: “Human CD94/NKG2A”. X-ray diffraction, 7 pockets (best druggability 0.52). MolNFT v1 #58782 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
3BDW
Type
protein
Length
477 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Natural killer cells antigen CD94; NKG2-A/NKG2-B type II integral membrane protein
UniProt
Q13241, P26715
Pockets
7 · best druggability 0.52

Structure

x-ray diffraction · 3 distinct chains · 18% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ANatural killer cells antigen CD94protein12318% helix, 32% strandQ13241
B, DNKG2-A/NKG2-B type II integral membrane proteinprotein11617% helix, 33% strandP26715
CNatural killer cells antigen CD94protein12218% helix, 32% strandQ13241

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11760.520.7929empty
21140.430.7723empty
31030.400.7624empty
4560.340.7816empty
5550.330.7712empty

Interfaces

3 interfaces between chains.

  • A–B · 784 Ų buried · 5 hydrogen bonds · protein-protein
  • C–D · 775 Ų buried · 5 hydrogen bonds · protein-protein
  • B–D · 277 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 16 disulfide (disulfide).

Compared structures

  • 3BDW · Human CD94/NKG2A · the same entry in another collection · chain A against A, TM-score 1.00
  • Q13241 · AlphaFold monomer V2.0 prediction for natural killer cells antigen CD94 (Q13241) · a predicted model of the same protein · chain C against A, TM-score 0.99
  • P26715 · AlphaFold monomer V2.0 prediction for NKG2-A/NKG2-B type II integral membrane protein… · a predicted model of the same protein · chain B against A, TM-score 0.97

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