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MolNFT v1 · #102893 · protein

Crystal structure of WD40 domain from toxoplasma gondii coronin

4OZU: “Crystal structure of WD40 domain from toxoplasma gondii coronin”. X-ray diffraction, 2 pockets (best druggability 0.86). MolNFT v1 #102893 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
4OZU
Type
protein
Length
390 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Coronin
UniProt
Q5Y1E7
Pockets
2 · best druggability 0.86

Structure

x-ray diffraction · 1 distinct chain · 4% helix, 45% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
ACoroninprotein3904% helix, 45% strandQ5Y1E7

Ligands and binding sites

  • TRS · 2-amino-2-hydroxymethyl-propane-1,3-diol · additive · chains A
  • ACT · Acetate ion · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16020.860.9160ACT
2500.500.8821empty

Modifications

Observed in the structure: 1 disulfide (disulfide).

Compared structures

  • 4OZU · Crystal Structure of WD40 domain from Toxoplasma gondii coronin · the same entry in another collection · chain A against A, TM-score 1.00

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