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Crystal structure of the tandem phosphatase domain of rptp CD45

Analyse Crystal structure of the tandem phosphatase domain of rptp CD45 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1YGR
Type
protein
Length
1,160 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
CD45 protein tyrosine phosphatase; T-cell receptor CD3 zeta itam-1
UniProt
P08575, P20963
Pockets
7 · best druggability 0.80

Structure

x-ray diffraction · 3 distinct chains · 31% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACD45 protein tyrosine phosphataseprotein57431% helix, 20% strandP08575
BCD45 protein tyrosine phosphataseprotein57431% helix, 20% strandP08575
C, DT-cell receptor CD3 zeta itam-1protein60% helix, 0% strandP20963

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14340.800.8845empty
24870.780.8637empty
31650.630.8529empty
41460.580.8318empty
5540.540.8916empty

Interfaces

3 interfaces between chains.

  • A–C · 514 Ų buried · 15 hydrogen bonds · protein-protein
  • B–D · 482 Ų buried · 18 hydrogen bonds · protein-protein
  • A–B · 42 Ų buried · 0 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 28 modified (engineered, phosphorylation).

Compared structures

  • 1YGR · Crystal structure of the tandem phosphatase domain of RPTP CD45 · the same entry in another collection · chain D against D, TM-score 1.00
  • P08575 · AlphaFold monomer V2.0 prediction for receptor-type tyrosine-protein phosphatase C… · a predicted model of the same protein · chain B against A, TM-score 0.99
  • P20963 · P20963 · a predicted model of the same protein · chain C against A, TM-score 0.51

Analyse

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