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Pyrococcus abyssi methyltransferase PATRM5A bound by sah and cognate tRNA

Analyse Pyrococcus abyssi methyltransferase PATRM5A bound by sah and cognate tRNA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5WT1
Type
protein + RNA
Length
797 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
TRNA (GUANINE(37)-N1)-methyltransferase TRM5A; RNA (76-mer)
EC
2.1.1.228
UniProt
Q9V2G1
Ligands
SAH
Pockets
16 · best druggability 0.77

Structure

x-ray diffraction · 4 distinct chains · 33% helix, 34% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ATRNA (GUANINE(37)-N1)-methyltransferase TRM5A (EC 2.1.1.228)protein33234% helix, 34% strandQ9V2G1
CRNA (76-mer)rna67——
BTRNA (GUANINE(37)-N1)-methyltransferase TRM5A (EC 2.1.1.228)protein33033% helix, 33% strandQ9V2G1
FRNA (76-mer)rna68——

Ligands and binding sites

  • SAH · S-adenosyl-L-homocysteine · ligand · 2 copies · chains A, C, B

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

Pockets

16 pockets found on a 1 Å grid, 12 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
17420.770.8244empty
27380.760.8242empty
3550.720.9920empty
41640.720.8933SAH
51520.680.8833SAH

Interfaces

2 interfaces between chains.

  • A–C · 2466 Ų buried · 57 hydrogen bonds · protein-nucleic
  • B–F · 2331 Ų buried · 47 hydrogen bonds · protein-nucleic

Compared structures

  • 5WT1 · Pyrococcus abyssi methyltransferase PaTrm5a bound by SAH and cognate tRNA · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9V2G1 · AlphaFold monomer V2.0 prediction for tRNA (GUANINE(37)-N1)/4-DEMETHYLWYOSINE(37)-methyltr… · a predicted model of the same protein · chain B against A, TM-score 0.95

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