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Pseudomonas aeruginosa phbh R220Q free of P-ohb

Analyse Pseudomonas aeruginosa phbh R220Q free of P-ohb in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1K0L
Type
protein
Length
394 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
P-hydroxybenzoate hydroxylase
EC
1.14.13.2
UniProt
P20586
Ligands
FAD, SO4, SO3
Pockets
3 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AP-hydroxybenzoate hydroxylase (EC 1.14.13.2)protein39441% helix, 26% strandP20586

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · chains A
  • SO4 · Sulfate ion · ion · 8 copies · chains A
  • SO3 · Sulfite ion · ion · 2 copies · 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16950.750.8165FAD
2620.530.8722empty
3730.340.7616empty

Compared structures

  • 1K0L · Pseudomonas aeruginosa phbh R220Q free of p-OHB · the same entry in another collection · chain A against A, TM-score 1.00
  • P20586 · AlphaFold monomer V2.0 prediction for P-hydroxybenzoate hydroxylase (P20586) · a predicted model of the same protein · chain A against A, TM-score 0.98

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