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The crystal structure of mouse PP1G in complex with truncated human PPP1R15B (631-669)

Analyse The crystal structure of mouse PP1G in complex with truncated human PPP1R15B… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
4V0W
Type
protein
Length
623 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
SERINE/THREONINE-protein phosphatase PP1-gamma catalytic subunit; Protein phosphatase 1…
EC
3.1.3.16
UniProt
P63087, Q5SWA1
Ligands
MN
Pockets
6 · best druggability 0.61

Structure

x-ray diffraction · 4 distinct chains · 32% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ASERINE/THREONINE-protein phosphatase PP1-gamma catalytic subunit (EC 3.1.3.16)protein29534% helix, 20% strandP63087
BProtein phosphatase 1 regulatory subunit 15Bprotein160% helix, 44% strandQ5SWA1
CSERINE/THREONINE-protein phosphatase PP1-gamma catalytic subunit (EC 3.1.3.16)protein29034% helix, 20% strandP63087
DProtein phosphatase 1 regulatory subunit 15Bprotein220% helix, 32% strandQ5SWA1

Ligands and binding sites

  • MN · Manganese (II) ion · metal · 4 copies · chains A, C

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

Pockets

6 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11990.610.8234empty
22140.610.8133empty
31950.510.7724empty
41620.470.7623empty
51520.450.7624MN

Interfaces

3 interfaces between chains.

  • C–D · 1327 Ų buried · 19 hydrogen bonds · protein-protein
  • A–B · 1029 Ų buried · 20 hydrogen bonds · protein-protein
  • A–C · 815 Ų buried · 10 hydrogen bonds · protein-protein

Compared structures

  • 4V0W · The crystal structure of mouse PP1G in complex with truncated human PPP1R15B (631-669) · the same entry in another collection · chain D against D, TM-score 1.00
  • P63087 · AlphaFold monomer V2.0 prediction for SERINE/THREONINE-protein phosphatase PP1-gamma… · a predicted model of the same protein · chain A against A, TM-score 1.00
  • Q5SWA1 · AlphaFold monomer V2.0 prediction for protein phosphatase 1 regulatory subunit 15B… · a predicted model of the same protein · chain B against A, TM-score 0.50

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