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MolNFT v1 · #19399 · protein

Crystal structure of the outer membrane protein ompx from escherichia COLI

1QJ8 · Outer membrane protein X: “Crystal structure of the outer membrane protein ompx from escherichia COLI”. X-ray diffraction, 1 ligand (PCL), 1 pocket (best druggability 0.53). MolNFT v1 #19399 on GenesisL1: 3D structure, binding sites…

PDB
1QJ8
Type
protein
Length
148 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Outer membrane protein X
UniProt
P36546
Ligands
PCL
Pockets
1 · best druggability 0.53

Structure

x-ray diffraction · 1 distinct chain · 0% helix, 82% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AOuter membrane protein Xprotein1480% helix, 82% strandP36546

Ligands and binding sites

  • PCL · Platinum(ii) di-chloride · ligand · 2 copies · chains A
  • C8E · (hydroxyethyloxy)tri(ethyloxy)octane · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11040.530.8219empty

Compared structures

  • 1QJ8 · Crystal structure of the outer membrane protein ompx from escherichia COLI · the same entry in another collection · chain A against A, TM-score 1.00

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