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Crystal structure of domain-swapped FAM96A minor dimer

Analyse Crystal structure of domain-swapped FAM96A minor dimer in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3UX3
Type
protein
Length
260 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
MIP18 family protein FAM96A
UniProt
Q9H5X1
Ligands
ZN
Pockets
3 · best druggability 0.81

Structure

x-ray diffraction · 1 distinct chain · 49% helix, 22% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BMIP18 family protein FAM96Aprotein13049% helix, 22% strandQ9H5X1

Ligands and binding sites

  • ZN · Zinc ion · metal · 3 copies · chains A, B
  • ACT · Acetate ion · additive · chains A, B

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
12000.810.9535ACT
2650.280.7313empty
3500.250.7314empty

Interfaces

1 interface between chains.

  • A–B · 2093 Ų buried · 23 hydrogen bonds · protein-protein

Compared structures

  • 3UX3 · Crystal Structure of Domain-Swapped Fam96a minor dimer · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9H5X1 · AlphaFold monomer V2.0 prediction for cytosolic iron-sulfur assembly component 2A (Q9H5X1) · a predicted model of the same protein · chain B against A, TM-score 0.71

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