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Structure of archaeoglobus fulgidis xpb

Analyse Structure of archaeoglobus fulgidis xpb in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
2FWR
Type
protein
Length
1,699 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA repair protein RAD25
UniProt
O29889
Ligands
PO4
Pockets
15 · best druggability 0.79

Structure

x-ray diffraction · 4 distinct chains · 33% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ADNA repair protein RAD25protein43433% helix, 20% strandO29889
BDNA repair protein RAD25protein42334% helix, 22% strandO29889
CDNA repair protein RAD25protein41433% helix, 20% strandO29889
DDNA repair protein RAD25protein42833% helix, 19% strandO29889

Ligands and binding sites

  • PO4 · Phosphate ion · ion · 8 copies · chains A, D, B, C
  • IPA · Isopropyl alcohol · additive · 3 copies · chains A, D

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

Pockets

15 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19480.790.8183PO4, IPA
28030.780.8282PO4
310570.740.7772empty
49710.720.7682empty
55840.630.7451empty

Interfaces

3 interfaces between chains.

  • A–D · 664 Ų buried · 7 hydrogen bonds · protein-protein
  • B–C · 656 Ų buried · 6 hydrogen bonds · protein-protein
  • A–B · 316 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 2FWR · Structure of Archaeoglobus Fulgidis XPB · the same entry in another collection · chain A against A, TM-score 1.00

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