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Crystal structure of an uncharacterized metal-dependent hydrolase from pyrococcus furiosus

Analyse Crystal structure of an uncharacterized metal-dependent hydrolase from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3ICJ
Type
protein
Length
468 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Uncharacterized metal-dependent hydrolase
UniProt
Q8U2I8
Ligands
ZN
Pockets
3 · best druggability 0.71

Structure

x-ray diffraction · 1 distinct chain · 39% helix, 24% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AUncharacterized metal-dependent hydrolaseprotein46839% helix, 24% strandQ8U2I8

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A

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
18320.710.7659empty
2830.400.7816empty
3910.330.7418empty

Modifications

Observed in the structure: 1 modified (carboxylation).

Compared structures

  • 3ICJ · Crystal structure of an uncharacterized metal-dependent hydrolase from pyrococcus furiosus · the same entry in another collection · chain A against A, TM-score 1.00

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