GL1X · GenesisL1 explorer

MolNFT v1 · #118234 · protein

Salicylate hydroxylase substrate complex

5EVY: “Salicylate hydroxylase substrate complex”. X-ray diffraction, 2 ligands (FAD, SAL), 3 pockets (best druggability 0.78). MolNFT v1 #118234 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5EVY
Type
protein
Length
411 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Salicylate hydroxylase
EC
1.14.13.1
UniProt
Q59713
Ligands
FAD, SAL
Pockets
3 · best druggability 0.78

Structure

x-ray diffraction · 1 distinct chain · 35% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
XSalicylate hydroxylase (EC 1.14.13.1)protein41135% helix, 24% strandQ59713

Ligands and binding sites

  • FAD · Flavin-adenine dinucleotide · ligand · chains X
  • SAL · 2-hydroxybenzoic acid · ligand · chains X

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
16430.780.8360FAD, SAL
21080.420.7819empty
3910.410.7816empty

Compared structures

  • 5EVY · Salicylate hydroxylase substrate complex · the same entry in another collection · chain X against X, TM-score 1.00

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