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MolNFT v1 · #120385 · protein

Crystal structure of human pyridoxal 5'-phosphate phosphatase (chronophin) mutant - C221S

5GYN · Pyridoxal phosphate phosphatase: “Crystal structure of human pyridoxal 5'-phosphate phosphatase (chronophin) mutant - C221S”. X-ray diffraction, 1 ligand (MG), 1 pocket (best druggability 0.71). MolNFT v1 #120385 on GenesisL1: 3D…

PDB
5GYN
Type
protein
Length
295 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pyridoxal phosphate phosphatase
EC
3.1.3.3, 3.1.3.74
UniProt
Q96GD0
Ligands
MG
Pockets
1 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 19% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APyridoxal phosphate phosphatase (EC 3.1.3.3, 3.1.3.74)protein29540% helix, 19% strandQ96GD0

Ligands and binding sites

  • MG · Magnesium ion · metal · 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
13010.710.8536MG

Compared structures

  • 5GYN · Crystal structure of human pyridoxal 5'-phosphate phosphatase (Chronophin) mutant - C221S · the same entry in another collection · chain A against A, TM-score 1.00
  • Q96GD0 · AlphaFold monomer V2.0 prediction for pyridoxal phosphate phosphatase (Q96GD0) · a predicted model of the same protein · chain A against A, TM-score 0.98

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