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MolNFT v1 · #187505 · protein

Polysaccharide ribofuranosyl transferase from thermobacillus composti

7SHG: “Polysaccharide ribofuranosyl transferase from thermobacillus composti”. X-ray diffraction, 2 ligands (MG, CL), 11 pockets (best druggability 0.77). MolNFT v1 #187505 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7SHG
Type
protein
Length
1,181 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribofuranosyl transferase
UniProt
L0EJI9
Ligands
MG, CL
Pockets
11 · best druggability 0.77

Structure

x-ray diffraction · 2 distinct chains · 53% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibofuranosyl transferaseprotein59152% helix, 14% strandL0EJI9
BRibofuranosyl transferaseprotein59053% helix, 14% strandL0EJI9

Ligands and binding sites

  • MG · Magnesium ion · metal · 3 copies · chains A, B
  • CL · Chloride ion · ion · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
19980.770.7994empty
29600.770.7986empty
32980.540.7525CL, MG
42620.520.7526empty
51250.420.7523empty

Interfaces

1 interface between chains.

  • A–B · 1036 Ų buried · 9 hydrogen bonds · protein-protein

Compared structures

  • 7SHG · Polysaccharide ribofuranosyl transferase from Thermobacillus composti · the same entry in another collection · chain A against A, TM-score 1.00

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