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MolNFT v1 · #169451 · protein

Structure of the C. botulinum neurotoxin serotype a light chain protease in complex with covalent inhibitor 53

6XCE: “Structure of the C. botulinum neurotoxin serotype a light chain protease in complex with covalent inhibitor 53”. X-ray diffraction, 1 ligand (UZM). MolNFT v1 #169451 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
6XCE
Type
protein
Length
423 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
P0DPI0
Ligands
UZM

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein423—P0DPI0

Ligands and binding sites

  • UZM · (3S)-3-(2,4-dichlorophenyl)-N~1~-hydroxy-N~5~-(3-sulfanylpropyl)pentanediamide · ligand · chains A

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

Compared structures

  • 6XCE · Structure of the C. botulinum neurotoxin serotype A light chain protease in complex with… · the same entry in another collection · chain A against A, TM-score 1.00
  • P0DPI0 · AlphaFold monomer V2.0 prediction for botulinum neurotoxin type a (P0DPI0) · a predicted model of the same protein · chain A against A, TM-score 0.95

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