3VS6: Crystal structure of HCK complexed with a pyrazolo-pyrimidine inhibitor tert-butyl {4-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl}carbamate

PDB ID: 3VS6Download
MMDB ID: 109516
PDB Deposition Date: 2012/4/21
Updated in MMDB: 2023/12
Experimental Method:
x-ray diffraction
Resolution: 2.373  Å
Source Organism:
Similar Structures:
Biological Unit for 3VS6: monomeric; determined by author and by software (PISA)
Molecular Components in 3VS6
Label Count Molecule
Protein (1 molecule)
1
Tyrosine-protein Kinase HCK
(Gene symbol: HCK)
Molecule annotation
Chemicals and Non-standard biopolymers (5 molecules)
1
3
CALCIUM IONCALCIUM ION
2
1
CHLORIDE IONCHLORIDE ION
3
1
tert-butyl {4-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl}carbamatetert-butyl {4-[4-amino-1-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-3-yl]-2-methoxyphenyl}carbamate
* Click molecule labels to explore molecular sequence information.
Citing MMDB
Madej T, Lanczycki CJ, Zhang D, Thiessen PA, Geer RC, Marchler-Bauer A, Bryant SH. " MMDB and VAST+: tracking structural similarities between macromolecular complexes. Nucleic Acids Res. 2014 Jan; 42(Database issue):D297-303