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Crystal structure of a probable acetyltransferases (gnat family) from chromobacterium violaceum atcc 12472

Analyse Crystal structure of a probable acetyltransferases (gnat family) from… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
3PZJ
Type
protein
Length
381 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Probable acetyltransferases
EC
2.3.1.-
UniProt
Q7NX87
Ligands
NA
Pockets
1 · best druggability 0.78

Structure

x-ray diffraction · 2 distinct chains · 32% helix, 33% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AProbable acetyltransferases (EC 2.3.1.-)protein19832% helix, 31% strandQ7NX87
BProbable acetyltransferases (EC 2.3.1.-)protein18332% helix, 34% strandQ7NX87

Ligands and binding sites

  • NA · Sodium ion · metal · 2 copies · chains A, B
  • EDO · 1,2-ethanediol · additive · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111940.780.80111EDO

Interfaces

1 interface between chains.

  • A–B · 1595 Ų buried · 33 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 6 modified (engineered).

Compared structures

  • 3PZJ · Crystal structure of a probable acetyltransferases (GNAT family) from Chromobacterium… · the same entry in another collection · chain A against A, TM-score 1.00

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