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MolNFT v1 · #123164 · protein + RNA

Crystal structure of chicken LGP2 with 5'P 12-mer dsrna at 3.6 a resolution

5JBJ: “Crystal structure of chicken LGP2 with 5'P 12-mer dsrna at 3.6 a resolution”. X-ray diffraction, 1 ligand (ZN), 9 pockets (best druggability 0.83). MolNFT v1 #123164 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5JBJ
Type
protein + RNA
Length
651 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
LGP2; RNA (5'-R(P*GP*GP*UP*AP*GP*CP*GP*CP*UP*AP*CP*C)-3')
UniProt
G0YYQ5
Ligands
ZN
Pockets
9 · best druggability 0.83

Structure

x-ray diffraction · 2 distinct chains · 45% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ALGP2protein62745% helix, 16% strandG0YYQ5
X, YRNA (5'-R(P*GP*GP*UP*AP*GP*CP*GP*CP*UP*AP*CP*C)-3')rna12——

Ligands and binding sites

  • ZN · Zinc ion · metal · chains A

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

Pockets

9 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111640.830.84103empty
27480.810.8543empty
34430.720.8350empty
42440.710.8733empty
51540.490.7820empty

Interfaces

3 interfaces between chains.

  • A–Y · 1256 Ų buried · 31 hydrogen bonds · protein-nucleic
  • A–X · 1115 Ų buried · 16 hydrogen bonds · protein-nucleic
  • X–Y · 572 Ų buried · 55 hydrogen bonds · nucleic-nucleic

Compared structures

  • 5JBJ · Crystal structure of chicken LGP2 with 5'p 12-mer dsRNA at 3.6 A resolution · the same entry in another collection · chain A against A, TM-score 1.00

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