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MolNFT v1 · #139651 · protein

Crystal structure of zinc binding protein zint at 1.49 ångström from E. COLI

5XM5 · Metal-binding protein zint: “Crystal structure of zinc binding protein zint at 1.49 ångström from E. COLI”. X-ray diffraction, 2 ligands (ZN, NA), 3 pockets (best druggability 0.68). MolNFT v1 #139651 on GenesisL1: 3D structure…

PDB
5XM5
Type
protein
Length
374 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Metal-binding protein zint
UniProt
P76344
Ligands
ZN, NA
Pockets
3 · best druggability 0.68

Structure

x-ray diffraction · 1 distinct chain · 30% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, BMetal-binding protein zintprotein18730% helix, 29% strandP76344

Ligands and binding sites

  • ZN · Zinc ion · metal · 6 copies · chains A, B
  • NA · Sodium ion · metal · 5 copies · 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, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16840.680.7665ZN, NA
24690.670.7947ZN, NA
3570.340.7820empty

Interfaces

1 interface between chains.

  • A–B · 311 Ų buried · 1 hydrogen bond · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5XM5 · Crystal structure of Zinc binding protein ZinT at 1.49 Angstrom from E. coli · the same entry in another collection · chain A against A, TM-score 1.00
  • P76344 · AlphaFold monomer V2.0 prediction for metal-binding protein zint (P76344) · a predicted model of the same protein · chain A against A, TM-score 0.99

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