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Crystal structure of a trap periplasmic solute binding protein from burkholderia ambifaria (BAM_6123), target efi-510059, with bound beta-D-glucuronate

Analyse Crystal structure of a trap periplasmic solute binding protein from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4N15
Type
protein
Length
301 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Trap dicarboxylate transporter, dctp subunit
UniProt
Q0B2F6
Ligands
BDP, MG
Pockets
3 · best druggability 0.61

Structure

x-ray diffraction · 1 distinct chain · 51% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATrap dicarboxylate transporter, dctp subunitprotein30151% helix, 19% strandQ0B2F6

Ligands and binding sites

  • BDP · beta-D-glucopyranuronic acid · sugar · chains A
  • MG · Magnesium ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1920.610.8832BDP
2730.340.7621empty
3500.280.7512empty

Compared structures

  • 4N15 · Crystal structure of a TRAP periplasmic solute binding protein from Burkholderia… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q0B2F6 · AlphaFold monomer V2.0 prediction for solute-binding protein BAMB_6123 (Q0B2F6) · a predicted model of the same protein · chain A against A, TM-score 1.00

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