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MolNFT v1 · #55889 · protein

Crystal structure of archaeal tRNA-methylase for position 56 (ATRM56) from pyrococcus horikoshii, complexed with S- adenosyl-L-methionine

2YY8 · UPF0106 protein PH0461: “Crystal structure of archaeal tRNA-methylase for position 56 (ATRM56) from pyrococcus horikoshii, complexed…”. X-ray diffraction, 2 ligands (MTA, SAM), 4 pockets (best druggability 0.69). MolNFT v1 #55889 on…

PDB
2YY8
Type
protein
Length
348 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
UPF0106 protein PH0461
UniProt
O58214
Ligands
MTA, SAM
Pockets
4 · best druggability 0.69

Structure

x-ray diffraction · 2 distinct chains · 40% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUPF0106 protein PH0461protein17439% helix, 21% strandO58214
BUPF0106 protein PH0461protein17441% helix, 22% strandO58214

Ligands and binding sites

  • MTA · 5'-deoxy-5'-methylthioadenosine · ligand · chains A
  • SAM · S-adenosylmethionine · ligand · 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
12750.690.8434MTA
22850.650.8233SAM
3560.430.8316empty
4520.390.8116empty

Interfaces

1 interface between chains.

  • A–B · 2349 Ų buried · 31 hydrogen bonds · protein-protein

Compared structures

  • 2YY8 · Crystal structure of archaeal tRNA-methylase for position 56 (aTrm56) from Pyrococcus… · the same entry in another collection · chain A against A, TM-score 1.00
  • O58214 · AlphaFold monomer V2.0 prediction for tRNA (CYTIDINE(56)-2'-O)-methyltransferase (O58214) · a predicted model of the same protein · chain A against A, TM-score 0.99

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