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MolNFT v1 · #151505 · protein

Crystal structure of mouse fetuin-B

6HPV: “Crystal structure of mouse fetuin-B”. X-ray diffraction, 1 ligand (NAG), 4 pockets (best druggability 0.58). MolNFT v1 #151505 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6HPV
Type
protein
Length
299 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fetuin-B
UniProt
Q9QXC1
Ligands
NAG
Pockets
4 · best druggability 0.58

Structure

x-ray diffraction · 1 distinct chain · 17% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFetuin-Bprotein29917% helix, 38% strandQ9QXC1

Ligands and binding sites

  • NAG · 2-acetamido-2-deoxy-beta-D-glucopyranose · sugar · 2 copies · chains A
  • ACT · Acetate ion · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12490.580.7936empty
21160.470.7919empty
31230.430.7728empty
4700.310.7415empty

Modifications

Observed in the structure: 5 disulfide, 2 glycan (disulfide, N-glycosylation).

Compared structures

  • 6HPV · Crystal structure of mouse fetuin-B · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9QXC1 · AlphaFold monomer V2.0 prediction for fetuin-B (Q9QXC1) · a predicted model of the same protein · chain A against A, TM-score 0.93

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