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MolNFT v1 · #123147 · protein + RNA

Crystal structure of chicken LGP2 with 5'PPP 10-mer dsrna and ADP- ALF4-MG2+ at 2.2 a resolution.

5JB2: “Crystal structure of chicken LGP2 with 5'PPP 10-mer dsrna and ADP- ALF4-MG2+ at 2.2 a resolution.”. X-ray diffraction, 4 ligands (ADP, ALF, MG), 8 pockets (best druggability 0.86). MolNFT v1 #123147 on GenesisL1: 3D structure…

PDB
5JB2
Type
protein + RNA
Length
691 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
LGP2; RNA (5'-R(*GPPP*GP*UP*AP*CP*GP*UP*AP*CP*CP*C)-3'); RNA…
UniProt
G0YYQ5
Ligands
ADP, ALF, MG, ZN
Pockets
8 · best druggability 0.86

Structure

x-ray diffraction · 3 distinct chains · 46% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALGP2protein67046% helix, 17% strandG0YYQ5
XRNA (5'-R(*GPPP*GP*UP*AP*CP*GP*UP*AP*CP*CP*C)-3')rna11——
YRNA (5'-R(*GPPP*GP*UP*AP*CP*GP*UP*AP*CP*C)-3')rna10——

Ligands and binding sites

  • ADP · Adenosine-5'-diphosphate · ligand · chains A
  • ALF · Tetrafluoroaluminate ion · ligand · chains A
  • MG · Magnesium ion · metal · 2 copies · chains A, X
  • ZN · Zinc ion · metal · 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
17630.860.8985empty
29170.820.8467empty
35540.700.7954ADP, ALF, MG
41870.700.8826empty
52010.690.8725empty

Interfaces

3 interfaces between chains.

  • A–Y · 1243 Ų buried · 36 hydrogen bonds · protein-nucleic
  • A–X · 1231 Ų buried · 28 hydrogen bonds · protein-nucleic
  • X–Y · 503 Ų buried · 43 hydrogen bonds · nucleic-nucleic

Modifications

Observed in the structure: 2 modified (nucleotide modification).

Compared structures

  • 5JB2 · Crystal structure of chicken LGP2 with 5'ppp 10-mer dsRNA and ADP-AlF4-Mg2+ at 2.2 A… · the same entry in another collection · chain A against A, TM-score 1.00

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