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MolNFT v1 · #70660 · protein

The crystal structure of the tungstate ABC transporter from geobacter sulfurreducens

3LR1 · Tungstate ABC transporter, periplasmic tungstate- binding…: “The crystal structure of the tungstate ABC transporter from geobacter sulfurreducens”. X-ray diffraction, 1 ligand (W), 2 pockets (best druggability 0.55). MolNFT v1…

PDB
3LR1
Type
protein
Length
232 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tungstate ABC transporter, periplasmic tungstate- binding protein
UniProt
Q749P2
Ligands
W
Pockets
2 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 44% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATungstate ABC transporter, periplasmic tungstate- binding proteinprotein23244% helix, 25% strandQ749P2

Ligands and binding sites

  • W · Tungsten ion · metal · 2 copies · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1640.550.8825W
2510.300.7613empty

Modifications

Observed in the structure: 6 modified (engineered).

Compared structures

  • 3LR1 · The crystal structure of the tungstate ABC transporter from Geobacter sulfurreducens · the same entry in another collection · chain A against A, TM-score 1.00

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