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Crystal structure of human adiponectin receptor 2 in complex with a C18 free fatty acid at 3.0 ångström resolution

Analyse Crystal structure of human adiponectin receptor 2 in complex with a C18 free… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5LXA
Type
protein
Length
522 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Adiponectin receptor protein 2; Anti-CD30 moab ki-4 scfv
UniProt
Q86V24
Ligands
OLA, OLB, ZN
Pockets
6 · best druggability 0.84

Structure

x-ray diffraction · 2 distinct chains · 41% helix, 23% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAdiponectin receptor protein 2protein28473% helix, 1% strandQ86V24
HAnti-CD30 moab ki-4 scfvprotein2384% helix, 48% strand—

Ligands and binding sites

  • OLA · Oleic acid · ligand · chains A
  • OLB · (2S)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate · ligand · chains A, H
  • ZN · Zinc ion · metal · chains A

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

Pockets

6 pockets found on a 1 Å grid, 2 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15380.840.9073OLA
21990.510.7731empty
31090.500.8119empty
41800.490.7633empty
5780.330.7517empty

Interfaces

1 interface between chains.

  • A–H · 926 Ų buried · 18 hydrogen bonds · protein-protein

Modifications

Observed in the structure: 2 disulfide (disulfide).

Compared structures

  • 5LXA · Crystal structure of human adiponectin receptor 2 in complex with a C18 free fatty acid… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q86V24 · AlphaFold monomer V2.0 prediction for adiponectin receptor protein 2 (Q86V24) · a predicted model of the same protein · chain A against A, TM-score 0.99

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