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MolNFT v1 · #181386 · protein

Structure of the alpha-N-methyltransferase (sonm) and ripp precursor (sona) heteromeric complex (with sah)

7LTE · Tp-methylase family protein: “Structure of the alpha-N-methyltransferase (sonm) and ripp precursor (sona) heteromeric complex (with sah)”. X-ray diffraction, 1 ligand (SAH), 8 pockets (best druggability 0.79). MolNFT v1 #181386 on…

PDB
7LTE
Type
protein
Length
661 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Tp-methylase family protein; Liga domain-containing protein
UniProt
Q8EGW3, Q8EGW2
Ligands
SAH
Pockets
8 · best druggability 0.79

Structure

x-ray diffraction · 3 distinct chains · 45% helix, 15% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, CTp-methylase family proteinprotein26237% helix, 21% strandQ8EGW3
BLiga domain-containing proteinprotein6958% helix, 1% strandQ8EGW2
DLiga domain-containing proteinprotein6862% helix, 1% strandQ8EGW2

Ligands and binding sites

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

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

Pockets

8 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11100.790.9825SAH
21070.770.9725SAH
32470.640.8238empty
42400.640.8233empty
52720.580.7838empty

Interfaces

5 interfaces between chains.

  • A–C · 2847 Ų buried · 49 hydrogen bonds · protein-protein
  • A–B · 1705 Ų buried · 22 hydrogen bonds · protein-protein
  • C–D · 1682 Ų buried · 24 hydrogen bonds · protein-protein
  • B–C · 524 Ų buried · 5 hydrogen bonds · protein-protein
  • A–D · 497 Ų buried · 4 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 4 modified (nonstandard).

Compared structures

  • 7LTE · Structure of the alpha-N-methyltransferase (SonM) and RiPP precursor (SonA) heteromeric… · the same entry in another collection · chain A against A, TM-score 1.00

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