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MolNFT v1 · #85475 · protein

Fusidic acid resistance protein fusb

4ADN · FAR1: “Fusidic acid resistance protein fusb”. X-ray diffraction, 3 ligands (NA, ZN, CL), 4 pockets (best druggability 0.81). MolNFT v1 #85475 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4ADN
Type
protein
Length
420 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
FAR1
UniProt
Q8GNY5
Ligands
NA, ZN, CL
Pockets
4 · best druggability 0.81

Structure

x-ray diffraction · 2 distinct chains · 43% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFAR1protein21342% helix, 21% strandQ8GNY5
BFAR1protein20744% helix, 19% strandQ8GNY5

Ligands and binding sites

  • NA · Sodium ion · metal · 8 copies · chains A, B
  • ZN · Zinc ion · metal · 2 copies · chains A, B
  • CL · Chloride ion · ion · chains A
  • GOL · Glycerol · additive · 3 copies · chains A, B
  • IMD · Imidazole · additive · 2 copies · chains A, B
  • PEG · Di(hydroxyethyl)ether · additive · 2 copies · chains A, B

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

Pockets

4 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111300.810.8374NA, PEG
21660.520.7817empty
31530.500.7818empty
41450.410.7425empty

Interfaces

1 interface between chains.

  • A–B · 1155 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 4ADN · Fusidic acid resistance protein FusB · the same entry in another collection · chain A against A, TM-score 1.00

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