GL1X · GenesisL1 explorer

MolNFT v1 · #101237 · protein + RNA

Crystal structure of listeria monocytogenes hfq in complex with U6 RNA

4NL3 · Protein hfq: “Crystal structure of listeria monocytogenes hfq in complex with U6 RNA”. X-ray diffraction, 12 pockets (best druggability 0.78). MolNFT v1 #101237 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4NL3
Type
protein + RNA
Length
887 residues
Chains
14
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Protein hfq; 5'-R(*UP*UP*UP*UP*UP*U)-3'
UniProt
B8DG33
Pockets
12 · best druggability 0.78

Structure

x-ray diffraction · 6 distinct chains · 20% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
D, J, G, KProtein hfqprotein7321% helix, 45% strandB8DG33
A, EProtein hfqprotein7221% helix, 44% strandB8DG33
B, HProtein hfqprotein7121% helix, 46% strandB8DG33
C, I, LProtein hfqprotein7419% helix, 45% strandB8DG33
FProtein hfqprotein7520% helix, 44% strandB8DG33
R, Z5'-R(*UP*UP*UP*UP*UP*U)-3'rna6——

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14750.780.8633empty
24590.770.8631empty
32650.560.7740empty
43590.560.7544empty
51420.450.7725empty

Interfaces

36 interfaces between chains.

  • D–A · 924 Ų buried · 19 hydrogen bonds · protein-protein
  • D–H · 906 Ų buried · 14 hydrogen bonds · protein-protein
  • E–F · 893 Ų buried · 18 hydrogen bonds · protein-protein
  • B–J · 891 Ų buried · 16 hydrogen bonds · protein-protein
  • K–L · 885 Ų buried · 17 hydrogen bonds · protein-protein

Compared structures

  • 4NL3 · Crystal Structure of Listeria monocytogenes Hfq in complex with U6 RNA · the same entry in another collection · chain D against D, TM-score 1.00

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