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Avra DELL154 with IP6, CoA

Analyse Avra DELL154 with IP6, CoA in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6BE0
Type
protein
Length
266 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Avra
UniProt
E8XKZ3
Ligands
IHP, COA
Pockets
3 · best druggability 0.44

Structure

x-ray diffraction · 1 distinct chain · 50% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAvraprotein26650% helix, 17% strandE8XKZ3

Ligands and binding sites

  • IHP · Inositol hexakisphosphate · ligand · chains A
  • COA · Coenzyme A · ligand · 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, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11120.440.7723empty
21130.420.7624IHP
3740.370.7718empty

Compared structures

  • 6BE0 · AvrA delL154 with IP6, CoA · the same entry in another collection · chain A against A, TM-score 1.00

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