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MolNFT v1 · #85724 · protein + RNA

Crystal structure of the CSY4-crrna product complex

4AL5 · CSY4 endoribonuclease: “Crystal structure of the CSY4-crrna product complex”. X-ray diffraction, 2 pockets (best druggability 0.66). MolNFT v1 #85724 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4AL5
Type
protein + RNA
Length
205 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
CSY4 endoribonuclease; 5'-R(*UP*UP*CP*AP*CP*UP*GP*CP*CP*GP*UP*AP*UP*AP…
UniProt
Q02MM2
Pockets
2 · best druggability 0.66

Structure

x-ray diffraction · 2 distinct chains · 30% helix, 25% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACSY4 endoribonucleaseprotein18930% helix, 25% strandQ02MM2
B5'-R(*UP*UP*CP*AP*CP*UP*GP*CP*CP*GP*UP*AP*UP*AP *GP*GP*CP*AP*GP*C)-3'rna16——

Ligands and binding sites

  • GOL · Glycerol · additive · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11850.660.8640empty
2520.270.7415empty

Interfaces

1 interface between chains.

  • A–B · 1255 Ų buried · 39 hydrogen bonds · protein-nucleic

Compared structures

  • 4AL5 · Crystal structure of the Csy4-crRNA product complex · the same entry in another collection · chain A against A, TM-score 1.00
  • Q02MM2 · AlphaFold monomer V2.0 prediction for CRISPR-associated endonuclease CAS6/CSY4 (Q02MM2) · a predicted model of the same protein · chain A against A, TM-score 0.97

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