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MolNFT v1 · #135788 · protein

Crystal structure of the fkbp domain of human aryl hydrocarbon receptor-interacting protein-like 1 (AIPL1) complexed with S- farnesyl-L-cysteine methyl ester

5U9I: “Crystal structure of the fkbp domain of human aryl hydrocarbon receptor-interacting protein-like 1 (AIPL1)…”. X-ray diffraction, 1 ligand (FAR), 2 pockets (best druggability 0.70). MolNFT v1 #135788 on GenesisL1: 3D structure…

PDB
5U9I
Type
protein
Length
150 residues
Chains
1
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Aryl hydrocarbon receptor-interacting protein-like 1 (AIPL1)
UniProt
Q9NZN9
Ligands
FAR
Pockets
2 · best druggability 0.70

Structure

x-ray diffraction · 1 distinct chain · 31% helix, 29% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AAryl hydrocarbon receptor-interacting protein-like 1 (AIPL1)protein15031% helix, 29% strandQ9NZN9

Ligands and binding sites

  • FAR · Farnesyl · ligand · chains A

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

Pockets

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

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
11750.700.8724FAR
2700.380.7817empty

Compared structures

  • 5U9I · Crystal structure of the FKBP domain of human aryl hydrocarbon receptor-interacting… · the same entry in another collection · chain A against A, TM-score 1.00
  • Q9NZN9 · AlphaFold monomer V2.0 prediction for aryl-hydrocarbon-interacting protein-like 1 (Q9NZN9) · a predicted model of the same protein · chain A against A, TM-score 0.89

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