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MolNFT v1 · #188814 · protein

Ribb from vibrio cholera bound with intermediate 1 of the reaction cycle and D-ribulose-5-phosphate (D-RU5P)

7UF4 · 3,4-dihydroxy-2-butanone 4-phosphate synthase: “Ribb from vibrio cholera bound with intermediate 1 of the reaction cycle and D-ribulose-5-phosphate (D-RU5P)”. X-ray diffraction, 3 ligands (N46, 5RP, MN), 1 pocket (best druggability…

PDB
7UF4
Type
protein
Length
216 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
3,4-dihydroxy-2-butanone 4-phosphate synthase
EC
4.1.99.12
UniProt
A0A0H6NPW4
Ligands
N46, 5RP, MN
Pockets
1 · best druggability 0.50

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 20% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A3,4-dihydroxy-2-butanone 4-phosphate synthase (EC 4.1.99.12)protein21640% helix, 20% strandA0A0H6NPW4

Ligands and binding sites

  • N46 · (2R)-2-hydroxy-3,4-dioxopentyl dihydrogen phosphate · ligand · chains A
  • 5RP · Ribulose-5-phosphate · ligand · chains A
  • MN · Manganese (II) ion · metal · 2 copies · chains A
  • EDO · 1,2-ethanediol · additive · 3 copies · chains A

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1600.500.8617N46, 5RP, MN

Compared structures

  • 7UF4 · RibB from Vibrio cholera bound with intermediate 1 of the reaction cycle and… · the same entry in another collection · chain A against A, TM-score 1.00

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