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MolNFT v1 · #98026 · protein

TRNA guanine transglycosylase (tgt) in complex with furanoside-based lin-benzoguanine 3

4KWO · Queuine tRNA-ribosyltransferase: “TRNA guanine transglycosylase (tgt) in complex with furanoside-based lin-benzoguanine 3”. X-ray diffraction, 2 ligands (1UD, ZN), 3 pockets (best druggability 0.64). MolNFT v1 #98026 on GenesisL1…

PDB
4KWO
Type
protein
Length
352 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Queuine tRNA-ribosyltransferase
EC
2.4.2.29
UniProt
P28720
Ligands
1UD, ZN
Pockets
3 · best druggability 0.64

Structure

x-ray diffraction · 1 distinct chain · 46% helix, 16% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AQueuine tRNA-ribosyltransferase (EC 2.4.2.29)protein35246% helix, 16% strandP28720

Ligands and binding sites

  • 1UD · methyl 6-[6-amino-2-(methylamino)-8-oxo-7,8-dihydro-1H-imidazo[4,5-g]quinazolin-4-yl]-5,6-dideoxy-3-O-methyl-beta-D-ribo-hexofuranoside · ligand · chains A
  • ZN · Zinc ion · metal · chains A
  • GOL · Glycerol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
13220.640.80491UD
2550.340.7817GOL
3610.290.7414empty

Compared structures

  • 4KWO · tRNA guanine transglycosylase (TGT) in complex with Furanoside-Based lin-Benzoguanine 3 · the same entry in another collection · chain A against A, TM-score 1.00

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