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MolNFT v1 · #147094 · protein

The CARD9 card domain-swapped dimer with a zinc ion bound to one of the two zinc binding sites

6E27 · Caspase recruitment domain-containing protein 9: “The CARD9 card domain-swapped dimer with a zinc ion bound to one of the two zinc binding sites”. X-ray diffraction, 1 ligand (ZN), 1 pocket (best druggability 0.40). MolNFT v1…

PDB
6E27
Type
protein
Length
184 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Caspase recruitment domain-containing protein 9
UniProt
Q9H257
Ligands
ZN
Pockets
1 · best druggability 0.40

Structure

x-ray diffraction · 2 distinct chains · 77% helix, 0% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
CCaspase recruitment domain-containing protein 9protein9574% helix, 0% strandQ9H257
DCaspase recruitment domain-containing protein 9protein8980% helix, 0% strandQ9H257

Ligands and binding sites

  • ZN · Zinc ion · metal · chains C, D

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

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11050.400.7617empty

Interfaces

1 interface between chains.

  • C–D · 3526 Ų buried · 29 hydrogen bonds · protein-protein

Compared structures

  • 6E27 · The CARD9 CARD domain-swapped dimer with a zinc ion bound to one of the two zinc binding… · the same entry in another collection · chain C against C, TM-score 1.00
  • Q9H257 · AlphaFold monomer V2.0 prediction for caspase recruitment domain- containing protein 9… · a predicted model of the same protein · chain D against A, TM-score 0.48

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