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Crystal Structure of Drosophila AnCE

Analyse Crystal Structure of Drosophila AnCE in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
1J38
Type
protein
Length
1,196 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v2 / PDB Bank
Contract
0xd58B01f6C18086e5202cdC5D7Ad3E41790360102
Owner
0xF4e1AA6f26B7DA48EeAD9B24a97927303eeA07b8
Resolution
2.6
Source
Drosophila melanogaster
Molecule
angiotensin converting enzyme
EC
3.4.15.1
UniProt
Q10714
Ligands
ZN
Pockets
8 · best druggability 0.87

Structure

x-ray diffraction · resolution 2.6 · 1 distinct chain · 59% helix, 4% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, Bangiotensin converting enzyme (EC 3.4.15.1)protein59859% helix, 4% strandQ10714

Ligands and binding sites

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

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

Pockets

8 pockets found on a 1 Å grid, 4 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
111620.870.88124empty
25510.850.9172empty
35310.650.7650empty
4740.560.8710empty
5720.470.8313empty

Interfaces

1 interface between chains.

  • A–B · 525 Ų buried · 3 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 8 disulfide (disulfide).

Compared structures

  • 1J38 · Crystal structure of drosophila ance · the same entry in another collection · chain A against A, TM-score 1.00
  • Q10714 · AlphaFold monomer V2.0 prediction for angiotensin-converting enzyme (Q10714) · a predicted model of the same protein · chain B against A, TM-score 0.98

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