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MolNFT v1 · #152555 · protein

Structure of arabidopsis thaliana ribokinase in unligand form

6ILR: “Structure of arabidopsis thaliana ribokinase in unligand form”. X-ray diffraction, 1 ligand (NA), 4 pockets (best druggability 0.71). MolNFT v1 #152555 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6ILR
Type
protein
Length
625 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribokinase
EC
2.7.1.15
UniProt
A1A6H3
Ligands
NA
Pockets
4 · best druggability 0.71

Structure

x-ray diffraction · 2 distinct chains · 36% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibokinase (EC 2.7.1.15)protein31235% helix, 24% strandA1A6H3
BRibokinase (EC 2.7.1.15)protein31337% helix, 24% strandA1A6H3

Ligands and binding sites

  • NA · Sodium ion · metal · 2 copies · chains A, B
  • PG4 · Tetraethylene glycol · additive · 2 copies · chains A, B

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

Pockets

4 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16490.710.7966PG4
27050.680.7692PG4
31090.380.7424empty
4550.330.7712empty

Interfaces

1 interface between chains.

  • A–B · 1319 Ų buried · 14 hydrogen bonds · protein-protein

Compared structures

  • 6ILR · Structure of Arabidopsis thaliana Ribokinase in unligand form · the same entry in another collection · chain A against A, TM-score 1.00
  • A1A6H3 · AlphaFold monomer V2.0 prediction for ribokinase (A1A6H3) · a predicted model of the same protein · chain B against A, TM-score 0.99

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