› 9h4d

X-ray diffraction
2.12Å resolution

Crystal structure of IL-17A in complex with compound 18

Released:
DOI: 10.2210/pdb9h4d/pdb
Model geometry
Fit model/data
PDB entry 9h4d coloured by chain, front view.
PDB entry 9h4d coloured by chain, side view.
PDB entry 9h4d coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Thiazole-Based IL-17 Inhibitors Discovered by Scaffold Morphing.
Velcicky J, Ngo E, Bauer MR, Meyer A, Schlapbach A, Racine S, Orain D, Pflieger D, Teixeira-Fouchard S, Dubois C, Goetz A, Steiner R, Palmieri M, Bussenault A, Stringer R, Larger P, Riek S, Schmutz P, Lehmann S, Scheufler C, Rondeau JM, Burkhart C, Knoepfel T, Gommermann N
ChemMedChem e202400851 (2024)
PMID: 39715021

Function and Biology Details

Biochemical function:
Biological process:
Cellular component:

Structure analysis Details

Assembly composition:
homo dimer (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-172495 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Interleukin-17A Chains: A, B
Molecule details ›
Chains: A, B
Length: 123 amino acids
Theoretical weight: 14.25 KDa
Source organism: Homo sapiens
Expression system: Escherichia coli
UniProt:
  • Canonical: Q16552 (Residues: 34-155; Coverage: 92%)
Gene names: CTLA8, IL17, IL17A
Sequence domains: Interleukin-17

Ligands and Environments

1 bound ligand:
Ligand A1ISH 1 x A1ISH
No modified residues

Experiments and Validation Details

wwPDB Validation report is not available for this entry.
X-ray source: SLS BEAMLINE X10SA
Spacegroup: C2221
Unit cell:
a: 64.601Å b: 85.42Å c: 120.161Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.237 0.237 0.241
Expression system: Escherichia coli

Quick links