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MolNFT v1 · #77448 · protein

X-ray structure of rlmn from escherichia COLI in complex with S- adenosylmethionine

3RFA · Ribosomal RNA large subunit methyltransferase N: “X-ray structure of rlmn from escherichia COLI in complex with S- adenosylmethionine”. X-ray diffraction, 2 ligands (SF4, SAM), 3 pockets (best druggability 0.84). MolNFT v1 #77448 on…

PDB
3RFA
Type
protein
Length
692 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Ribosomal RNA large subunit methyltransferase N
EC
2.1.1.192
UniProt
P36979
Ligands
SF4, SAM
Pockets
3 · best druggability 0.84

Structure

x-ray diffraction · 2 distinct chains · 41% helix, 21% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ARibosomal RNA large subunit methyltransferase N (EC 2.1.1.192)protein33341% helix, 22% strandP36979
BRibosomal RNA large subunit methyltransferase N (EC 2.1.1.192)protein35941% helix, 20% strandP36979

Ligands and binding sites

  • SF4 · Iron/sulfur cluster · ligand · 2 copies · chains A, B
  • SAM · S-adenosylmethionine · ligand · 2 copies · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18260.840.8670SF4, SAM
29450.810.8269SF4, SAM
34840.590.7443empty

Interfaces

1 interface between chains.

  • A–B · 78 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 1 modified (methylation).

Compared structures

  • 3RFA · X-ray structure of RlmN from Escherichia coli in complex with S-adenosylmethionine · the same entry in another collection · chain B against B, TM-score 1.00
  • P36979 · AlphaFold monomer V2.0 prediction for dual-specificity RNA methyltransferase rlmn (P36979) · a predicted model of the same protein · chain A against A, TM-score 0.99

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