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FABP4 in complex with 6-chloro-2-isopropyl-4-(3-isopropyl-phenyl)- quinoline-3-carboxylic acid

Analyse FABP4 in complex with 6-chloro-2-isopropyl-4-(3-isopropyl-phenyl)… in the GL1X research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides, crosslinks and neighbours on the 3D structure.

PDB
5HZ6
Type
protein
Length
131 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Fatty acid-binding protein, adipocyte
UniProt
P15090
Ligands
65Y
Pockets
1 · best druggability 0.84

Structure

x-ray diffraction · 1 distinct chain · 13% helix, 58% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AFatty acid-binding protein, adipocyteprotein13113% helix, 58% strandP15090

Ligands and binding sites

  • 65Y · 6-Chloro-2-isopropyl-4-(3-isopropyl-phenyl)-quinoline-3-carboxylic acid · ligand · 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
13130.840.943665Y

Compared structures

  • 5HZ6 · FABP4 in complex with 6-Chloro-2-isopropyl-4-(3-isopropyl-phenyl)-quinoline-3-carboxylic… · the same entry in another collection · chain A against A, TM-score 1.00
  • P15090 · AlphaFold monomer V2.0 prediction for fatty acid-binding protein, adipocyte (P15090) · a predicted model of the same protein · chain A against A, TM-score 0.99

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