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MolNFT v1 · #31209 · protein

Alkaline phosphatase (D153H)

2ANH: “Alkaline phosphatase (D153H)”. X-ray diffraction, 2 ligands (ZN, PO4), 5 pockets (best druggability 0.79). MolNFT v1 #31209 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2ANH
Type
protein
Length
892 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Alkaline phosphatase
EC
3.1.3.1
UniProt
P00634
Ligands
ZN, PO4
Pockets
5 · best druggability 0.79

Structure

x-ray diffraction · 1 distinct chain · 32% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BAlkaline phosphatase (EC 3.1.3.1)protein44632% helix, 21% strandP00634

Ligands and binding sites

  • ZN · Zinc ion · metal · 6 copies · chains A, B
  • PO4 · Phosphate ion · ion · 3 copies · chains A, B

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

Pockets

5 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1970.790.9925empty
2590.530.8814empty
3540.500.8715empty
41100.330.7320PO4
5940.320.7319PO4

Interfaces

1 interface between chains.

  • A–B · 3924 Ų buried · 65 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 disulfide (disulfide).

Compared structures

  • 2ANH · Alkaline phosphatase (D153H) · the same entry in another collection · chain A against A, TM-score 1.00
  • P00634 · AlphaFold monomer V2.0 prediction for alkaline phosphatase (P00634) · a predicted model of the same protein · chain A against A, TM-score 1.00

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