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MolNFT v1 · #186383 · protein

Aeronamide N-methyltransferase, aere (N231A)

7RC5 · Methyltransferase family protein: “Aeronamide N-methyltransferase, aere (N231A)”. X-ray diffraction, 2 ligands (SAH, CA), 3 pockets (best druggability 0.75). MolNFT v1 #186383 on GenesisL1: 3D structure, binding sites and pockets in…

PDB
7RC5
Type
protein
Length
375 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Methyltransferase family protein
UniProt
A0A329B7M1
Ligands
SAH, CA
Pockets
3 · best druggability 0.75

Structure

x-ray diffraction · 1 distinct chain · 41% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AMethyltransferase family proteinprotein37541% helix, 23% strandA0A329B7M1

Ligands and binding sites

  • SAH · S-adenosyl-L-homocysteine · ligand · chains A
  • CA · Calcium ion · metal · chains A
  • PGE · Triethylene glycol · 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
16790.750.8176SAH
2780.320.7420empty
3500.310.7712empty

Compared structures

  • 7RC5 · Aeronamide N-methyltransferase, AerE (N231A) · the same entry in another collection · chain A against A, TM-score 1.00

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