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MolNFT v1 · #145131 · protein

Proteus vulgaris higa antitoxin structure

6CF1 · Antitoxin higa: “Proteus vulgaris higa antitoxin structure”. X-ray diffraction, 1 ligand (K), 1 pocket (best druggability 0.43). MolNFT v1 #145131 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6CF1
Type
protein
Length
186 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Antitoxin higa
UniProt
Q7A224
Ligands
K
Pockets
1 · best druggability 0.43

Structure

x-ray diffraction · 2 distinct chains · 59% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAntitoxin higaprotein9259% helix, 0% strandQ7A224
BAntitoxin higaprotein9459% helix, 0% strandQ7A224

Ligands and binding sites

  • K · Potassium ion · metal · 5 copies · chains A, 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
1880.430.7916empty

Interfaces

1 interface between chains.

  • A–B · 1473 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 6CF1 · Proteus vulgaris HigA antitoxin structure · the same entry in another collection · chain A against A, TM-score 1.00
  • Q7A224 · AlphaFold monomer V2.0 prediction for antitoxin higa (Q7A224) · a predicted model of the same protein · chain A against A, TM-score 0.93

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