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MolNFT v1 · #171557 · protein

Fructo-oligosaccharide transporter bt 1762-63

6Z9A · Susd homolog: “Fructo-oligosaccharide transporter bt 1762-63”. X-ray diffraction, 3 ligands (FRU, MG, CL), 20 pockets (best druggability 0.82). MolNFT v1 #171557 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6Z9A
Type
protein
Length
1,473 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Susd homolog; Susc homolog
UniProt
Q8A6W4, Q8A6W3
Ligands
FRU, MG, CL
Pockets
20 · best druggability 0.82

Structure

x-ray diffraction · 2 distinct chains · 22% helix, 31% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASusd homologprotein55243% helix, 8% strandQ8A6W4
BSusc homologprotein9219% helix, 45% strandQ8A6W3

Ligands and binding sites

  • FRU · beta-D-fructofuranose · sugar · 7 copies · chains B, A
  • MG · Magnesium ion · metal · chains B
  • CL · Chloride ion · ion · chains A, B

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

Pockets

20 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11670.820.9740empty
26780.770.8382empty
34920.700.8049empty
4510.680.9828empty
53790.670.8149empty

Interfaces

1 interface between chains.

  • A–B · 4026 Ų buried · 70 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 6Z9A · Fructo-oligosaccharide transporter BT 1762-63 · the same entry in another collection · chain A against A, TM-score 1.00

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