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MolNFT v1 · #105616 · protein

PP2CA

4RA2 · Protein phosphatase 1A: “PP2CA”. X-ray diffraction, 2 ligands (MN, PO4), 3 pockets (best druggability 0.45). MolNFT v1 #105616 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4RA2
Type
protein
Length
363 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein phosphatase 1A
EC
3.1.3.16
UniProt
P35813
Ligands
MN, PO4
Pockets
3 · best druggability 0.45

Structure

x-ray diffraction · 1 distinct chain · 36% helix, 26% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein phosphatase 1A (EC 3.1.3.16)protein36336% helix, 26% strandP35813

Ligands and binding sites

  • MN · Manganese (II) ion · metal · 2 copies · chains A
  • PO4 · Phosphate ion · ion · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11060.450.7817empty
21070.390.7619MN, PO4
3820.350.7518empty

Compared structures

  • 4RA2 · PP2Ca · the same entry in another collection · chain A against A, TM-score 1.00
  • P35813 · AlphaFold monomer V2.0 prediction for protein phosphatase 1A (P35813) · a predicted model of the same protein · chain A against A, TM-score 1.00

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