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MolNFT v1 · #157746 · protein

YOEB/PARE toxin from agrobacterium tumefaciens

6N90 · Uncharacterized protein: “YOEB/PARE toxin from agrobacterium tumefaciens”. X-ray diffraction, 1 ligand (TEW), 1 pocket (best druggability 0.31). MolNFT v1 #157746 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6N90
Type
protein
Length
174 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized protein
UniProt
A9CID9
Ligands
TEW
Pockets
1 · best druggability 0.31

Structure

x-ray diffraction · 2 distinct chains · 37% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUncharacterized proteinprotein8836% helix, 35% strandA9CID9
BUncharacterized proteinprotein8637% helix, 31% strandA9CID9

Ligands and binding sites

  • TEW · 6-tungstotellurate(VI) · ligand · chains B

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
1690.310.7418empty

Interfaces

1 interface between chains.

  • A–B · 769 Ų buried · 13 hydrogen bonds · protein-protein

Compared structures

  • 6N90 · YoeB/ParE toxin from Agrobacterium tumefaciens · the same entry in another collection · chain A against A, TM-score 1.00

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