› 5hes

X-ray diffraction
2.14Å resolution

Human leucine zipper- and sterile alpha motif-containing kinase (ZAK, MLT, HCCS-4, MRK, AZK, MLTK) in complex with vemurafenib

Released:
DOI: 10.2210/pdb5hes/pdb
PDB entry 5hes coloured by chain, front view.
PDB entry 5hes coloured by chain, side view.
PDB entry 5hes coloured by chain, top view.
Source organism: Homo sapiens
Primary publication:
Structure of the Human Protein Kinase ZAK in Complex with Vemurafenib.
Mathea S, Abdul Azeez KR, Salah E, Tallant C, Wolfreys F, Konietzny R, Fischer R, Lou HJ, Brennan PE, Schnapp G, Pautsch A, Kessler BM, Turk BE, Knapp S
ACS Chem Biol 11 1595-602 (2016)
PMID: 26999302

Function and Biology Details

Reaction catalysed: 
ATP + a protein = ADP + a phosphoprotein
Biochemical function:
Biological process:
Cellular component:
  • not assigned
Sequence domains:

Structure analysis Details

Assembly composition:
monomeric (preferred)
Assembly name:
PDBe Complex ID:
PDB-CPX-192716 (preferred)
Entry contents:
1 distinct polypeptide molecule
Macromolecule:
Mitogen-activated protein kinase kinase kinase 20 Chains: A, B
Molecule details ›
Chains: A, B
Length: 307 amino acids
Theoretical weight: 35.23 KDa
Source organism: Homo sapiens
Expression system: Spodoptera frugiperda
UniProt:
  • Canonical: Q9NYL2 (Residues: 5-309; Coverage: 38%)
Gene names: HCCS4, MAP3K20, MLK7, MLTK, ZAK
Sequence domains: Protein tyrosine and serine/threonine kinase
Structure domains:

Ligands and Environments

2 bound ligands:
Ligand 032 2 x 032
Ligand EDO 2 x EDO
1 modified residue:
Ligand TPO 2 x TPO

Experiments and Validation Details

Entry percentile scores
X-ray source: DIAMOND BEAMLINE I03
Spacegroup: P41
Unit cell:
a: 78.712Å b: 78.712Å c: 133.345Å
α: 90° β: 90° γ: 90°
R-values:
R R work R free
0.18 0.18 0.226
Expression system: Spodoptera frugiperda

Quick links

Citations

6 citation in other articles

Vemurafenib Inhibits Active PTK6 in PTEN-null Prostate Tumor Cells.
Wozniak et al. (2019)
5 more

2 mentions without citation

Structure of the Human Protein Kinase ZAK in Complex with Vemurafenib.
Mathea et al. (2016)
1 more