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2.1 ångström crystal structure of the complex between the nuclear U8 snorna decapping nudix hydrolase X29, manganese and M7G-ppp-a

Analyse 2.1 ångström crystal structure of the complex between the nuclear U8 snorna… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2A8T
Type
protein
Length
383 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
U8 snorna-binding protein X29
EC
3.6.1.-
UniProt
Q569R2
Ligands
MGT, ADN, MN
Pockets
3 · best druggability 0.74

Structure

x-ray diffraction · 2 distinct chains · 34% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AU8 snorna-binding protein X29 (EC 3.6.1.-)protein19234% helix, 32% strandQ569R2
BU8 snorna-binding protein X29 (EC 3.6.1.-)protein19134% helix, 33% strandQ569R2

Ligands and binding sites

  • MGT · 7N-methyl-8-hydroguanosine-5'-triphosphate · ligand · 2 copies · chains A, B
  • ADN · Adenosine · ligand · 2 copies · chains A, B
  • MN · Manganese (II) ion · metal · 7 copies · 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, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1720.740.9819empty
21860.530.7827MN, ADN
32170.530.7733MN, ADN

Interfaces

1 interface between chains.

  • A–B · 1354 Ų buried · 16 hydrogen bonds · protein-protein

Compared structures

  • 2A8T · 2.1 Angstrom Crystal Structure of the Complex Between the Nuclear U8 snoRNA Decapping… · the same entry in another collection · chain B against B, TM-score 1.00

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