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MolNFT v1 · #53541 · protein

Clostridium perfringens alpha-toxin strain NCTC8237

2WXT · Phospholipase C: “Clostridium perfringens alpha-toxin strain NCTC8237”. X-ray diffraction, 3 ligands (CD, CA, ZN), 4 pockets (best druggability 0.69). MolNFT v1 #53541 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
2WXT
Type
protein
Length
359 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Phospholipase C
EC
3.1.4.3
UniProt
Q0TV31
Ligands
CD, CA, ZN
Pockets
4 · best druggability 0.69

Structure

x-ray diffraction · 1 distinct chain · 45% helix, 17% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APhospholipase C (EC 3.1.4.3)protein35945% helix, 17% strandQ0TV31

Ligands and binding sites

  • CD · Cadmium ion · metal · 8 copies · chains A
  • CA · Calcium ion · metal · 2 copies · chains A
  • ZN · Zinc ion · metal · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11420.690.8931empty
21320.500.8025empty
3800.410.7914empty
41050.390.7516CD

Compared structures

  • 2WXT · Clostridium perfringens alpha-toxin strain NCTC8237 · the same entry in another collection · chain A against A, TM-score 1.00
  • Q0TV31 · AlphaFold monomer V2.0 prediction for phospholipase C (Q0TV31) · a predicted model of the same protein · chain A against A, TM-score 0.98

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