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Structure of L509V CAO1 - growth condition 1

Analyse Structure of L509V CAO1 - growth condition 1 in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
6N1Y
Type
protein
Length
1,988 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Carotenoid oxygenase
UniProt
A0A0B0DIC8
Ligands
FE2, CL
Pockets
20 · best druggability 0.88

Structure

x-ray diffraction · 1 distinct chain · 8% helix, 38% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
A, B, C, DCarotenoid oxygenaseprotein4978% helix, 38% strandA0A0B0DIC8

Ligands and binding sites

  • FE2 · Fe (II) ion · metal · 4 copies · chains A, B, C, D
  • CL · Chloride ion · ion · 4 copies · chains A, B, C, D

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

Pockets

20 pockets found on a 1 Å grid, 14 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
110640.880.89142empty
27820.840.87104empty
36640.840.8880empty
46310.840.8881empty
56410.840.8877empty

Interfaces

4 interfaces between chains.

  • B–D · 1522 Ų buried · 37 hydrogen bonds · protein-protein
  • A–C · 1519 Ų buried · 37 hydrogen bonds · protein-protein
  • B–C · 385 Ų buried · 3 hydrogen bonds · protein-protein
  • A–D · 372 Ų buried · 3 hydrogen bonds · protein-protein

Compared structures

  • 6N1Y · Structure of L509V CAO1 - growth condition 1 · the same entry in another collection · chain A against A, TM-score 1.00

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