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Crystal structure of LARP1-unique domain DM15 bound to M7GPPPC

Analyse Crystal structure of LARP1-unique domain DM15 bound to M7GPPPC in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5V87
Type
protein
Length
295 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
La-related protein 1
UniProt
Q6PKG0
Ligands
MGT, 91P
Pockets
3 · best druggability 0.63

Structure

x-ray diffraction · 2 distinct chains · 74% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALa-related protein 1protein14775% helix, 0% strandQ6PKG0
BLa-related protein 1protein14872% helix, 0% strandQ6PKG0

Ligands and binding sites

  • MGT · 7N-methyl-8-hydroguanosine-5'-triphosphate · ligand · chains A
  • 91P · [[(2~{R},3~{S},4~{R},5~{R})-5-(2-azanyl-7-methyl-6-oxidanylidene-1~{H}-purin-9-ium-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [[(2~{R},3~{S},4~{R},5~{R})-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] hydrogen phosphate · ligand · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13520.630.7946MGT, 91P
21320.520.8017empty
31000.380.7525empty

Interfaces

1 interface between chains.

  • A–B · 881 Ų buried · 5 hydrogen bonds · protein-protein

Compared structures

  • 5V87 · Crystal structure of LARP1-unique domain DM15 bound to m7GpppC · the same entry in another collection · chain A against A, TM-score 1.00
  • Q6PKG0 · AlphaFold monomer V2.0 prediction for la-related protein 1 (Q6PKG0) · a predicted model of the same protein · chain A against A, TM-score 0.99

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