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MolNFT v1 · #173023 · protein

Crystal structure of NLRP3 nacht domain in complex with a potent inhibitor

7ALV: “Crystal structure of NLRP3 nacht domain in complex with a potent inhibitor”. X-ray diffraction, 2 ligands (RM5, ADP). MolNFT v1 #173023 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
7ALV
Type
protein
Length
472 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
UniProt
Q96P20
Ligands
RM5, ADP

Structure

x-ray diffraction · 1 distinct chain.

ChainMoleculeTypeResiduesSecondary structureUniProt
A—protein472—Q96P20

Ligands and binding sites

  • RM5 · 1-[4-chloranyl-2,6-di(propan-2-yl)phenyl]-3-[4-(2-oxidanylpropan-2-yl)furan-2-yl]sulfonyl-urea · ligand · chains A
  • ADP · Adenosine-5'-diphosphate · ligand · chains A

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

Compared structures

  • 7ALV · Crystal Structure of NLRP3 NACHT domain in complex with a potent inhibitor · the same entry in another collection · chain A against A, TM-score 1.00
  • Q96P20 · AlphaFold monomer V2.0 prediction for nacht, lrr and pyd domains- containing protein 3… · a predicted model of the same protein · chain A against A, TM-score 0.64

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