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MolNFT v1 · #136700 · protein

Structure of PHD2 in complex with 1,2,4-triazolo-[1,5-A]PYRIDINE

5V18 · Egl nine homolog 1: “Structure of PHD2 in complex with 1,2,4-triazolo-[1,5-A]PYRIDINE”. X-ray diffraction, 3 ligands (8UY, FE2, SO4), 1 pocket (best druggability 0.71). MolNFT v1 #136700 on GenesisL1: 3D structure, binding sites and…

PDB
5V18
Type
protein
Length
215 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Egl nine homolog 1
EC
1.14.11.29
UniProt
Q9GZT9
Ligands
8UY, FE2, SO4
Pockets
1 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 31% helix, 27% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AEgl nine homolog 1 (EC 1.14.11.29)protein21531% helix, 27% strandQ9GZT9

Ligands and binding sites

  • 8UY · 4-([1,2,4]triazolo[1,5-a]pyridin-5-yl)benzonitrile · ligand · chains A
  • FE2 · Fe (II) ion · metal · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12920.710.85348UY, FE2

Compared structures

  • 5V18 · Structure of PHD2 in complex with 1,2,4-Triazolo-[1,5-a]pyridine · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9GZT9 · AlphaFold monomer V2.0 prediction for egl nine homolog 1 (Q9GZT9) · a predicted model of the same protein · chain A against A, TM-score 0.94

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