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Crystal structure of an abridged ser to ala mutant of the mature ectodomain of the human receptor-type protein-tyrosine phosphatase ICA512/IA-2 at pH 8.5

Analyse Crystal structure of an abridged ser to ala mutant of the mature ectodomain of… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3NG8
Type
protein
Length
174 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Receptor-type tyrosine-protein phosphatase-like N
UniProt
Q16849
Ligands
CA
Pockets
1 · best druggability 0.55

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BReceptor-type tyrosine-protein phosphatase-like Nprotein8741% helix, 30% strandQ16849

Ligands and binding sites

  • CA · Calcium ion · metal · chains B

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
11120.550.8431empty

Interfaces

1 interface between chains.

  • A–B · 538 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 3NG8 · Crystal structure of an abridged SER TO ALA MUTANT OF THE MATURE ECTODOMAIN of the human… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q16849 · AlphaFold monomer V2.0 prediction for receptor-type tyrosine-protein phosphatase-like N… · a predicted model of the same protein · chain A against A, TM-score 0.97

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