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MolNFT v1 · #93459 · protein

Crystal structure of the tyrosine phosphatase shp-2 with Q506P mutation

4H34 · Tyrosine-protein phosphatase non-receptor type 11: “Crystal structure of the tyrosine phosphatase shp-2 with Q506P mutation”. X-ray diffraction, 4 pockets (best druggability 0.64). MolNFT v1 #93459 on GenesisL1: 3D structure…

PDB
4H34
Type
protein
Length
486 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tyrosine-protein phosphatase non-receptor type 11
EC
3.1.3.48
UniProt
Q06124
Pockets
4 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 30% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATyrosine-protein phosphatase non-receptor type 11 (EC 3.1.3.48)protein48630% helix, 24% strandQ06124

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 6 copies · chains A
  • GOL · Glycerol · additive · 2 copies · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14610.640.7743empty
22270.530.7749EDO
3800.430.8018empty
4560.270.7415empty

Compared structures

  • 4H34 · Crystal structure of the tyrosine phosphatase SHP-2 with Q506P mutation · the same entry in another collection · chain A against A, TM-score 1.00

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