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PRMT5 bound to the pbm peptide from picln

Analyse PRMT5 bound to the pbm peptide from picln in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6V0O
Type
protein
Length
944 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein arginine N-methyltransferase 5; Methylosome protein 50; Pbm peptide
EC
2.1.1.320
UniProt
O14744, Q9BQA1
Ligands
SFG, ACE
Pockets
8 · best druggability 0.85

Structure

x-ray diffraction · 3 distinct chains · 20% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProtein arginine N-methyltransferase 5 (EC 2.1.1.320)protein62530% helix, 27% strandO14744
BMethylosome protein 50protein3091% helix, 50% strandQ9BQA1
DPbm peptideprotein100% helix, 0% strand—

Ligands and binding sites

  • SFG · Sinefungin · ligand · chains A
  • ACE · Acetyl group · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16020.850.9066empty
25190.830.8955empty
33770.790.8849SFG, ACE
44070.650.7839empty
51560.520.7940empty

Interfaces

2 interfaces between chains.

  • A–B · 2159 Ų buried · 38 hydrogen bonds · protein-protein
  • A–D · 547 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 6V0O · PRMT5 bound to the PBM peptide from pICln · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9BQA1 · AlphaFold monomer V2.0 prediction for methylosome protein 50 (Q9BQA1) · a predicted model of the same protein · chain B against A, TM-score 0.99
  • O14744 · AlphaFold monomer V2.0 prediction for protein arginine N-methyltransferase 5 (O14744) · a predicted model of the same protein · chain A against A, TM-score 0.98

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