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Crystal structure of prl-1 complex with compound analogy 3

Analyse Crystal structure of prl-1 complex with compound analogy 3 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5BX1
Type
protein
Length
153 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein tyrosine phosphatase type iva 1
EC
3.1.3.48
UniProt
Q93096
Ligands
4XA, SO4

Structure

x-ray diffraction · 1 distinct chain · 42% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein tyrosine phosphatase type iva 1 (EC 3.1.3.48)protein15342% helix, 16% strandQ93096

Ligands and binding sites

  • 4XA · 3-(5,6-dimethyl-2H-isoindol-2-yl)-N'-[(E)-furan-2-ylmethylidene]benzohydrazide · ligand · chains A
  • SO4 · Sulfate ion · ion · 2 copies · chains A

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

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 5BX1 · Crystal Structure of PRL-1 complex with compound analogy 3 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q93096 · AlphaFold monomer V2.0 prediction for protein tyrosine phosphatase type iva 1 (Q93096) · a predicted model of the same protein · chain A against A, TM-score 0.96

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