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Csl (rbp-jk) bound to DNA

Analyse Csl (rbp-jk) bound to DNA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3BRG
Type
protein + DNA
Length
444 residues
Chains
3
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'- D(*DAP*DAP*DTP*DCP*DTP*DTP*DTP*DCP*DCP*DCP*DAP*DCP*DAP*DGP*DT)-3'); DNA (5'…
UniProt
P31266
Pockets
10 · best druggability 0.73

Structure

x-ray diffraction · 3 distinct chains · 8% helix, 44% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA (5'- D(*DAP*DAP*DTP*DCP*DTP*DTP*DTP*DCP*DCP*DCP*DAP*DCP*DAP*DGP*DT)-3')dna15——
BDNA (5'- D(*DTP*DTP*DAP*DCP*DTP*DGP*DTP*DGP*DGP*DGP*DAP*DAP*DAP*DGP*DA)-3')dna15——
CRecombining binding protein suppressor of hairlessprotein4148% helix, 44% strandP31266

Ligands and binding sites

  • EDO · 1,2-ethanediol · additive · 12 copies · chains C, A, B

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

Pockets

10 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
14210.730.8359EDO
22690.550.7725empty
31280.540.8219empty
41480.440.7626EDO
5890.400.7720EDO

Interfaces

3 interfaces between chains.

  • B–C · 626 Ų buried · 10 hydrogen bonds · protein-nucleic
  • A–B · 590 Ų buried · 55 hydrogen bonds · nucleic-nucleic
  • A–C · 511 Ų buried · 6 hydrogen bonds · protein-nucleic

Compared structures

  • 3BRG · CSL (RBP-Jk) bound to DNA · the same entry in another collection · chain A against A, TM-score 1.00
  • P31266 · AlphaFold monomer V2.0 prediction for recombining binding protein suppressor of hairless… · a predicted model of the same protein · chain C against A, TM-score 0.97

Analyse

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