4AFE: Nek2 bound to hybrid compound 21

PDB ID: 4AFEDownload
MMDB ID: 99046
PDB Deposition Date: 2012/1/19
Updated in MMDB: 2023/12
Experimental Method:
x-ray diffraction
Resolution: 2.597  Å
Source Organism:
Similar Structures:
Biological Unit for 4AFE: monomeric; determined by author and by software (PISA)
Molecular Components in 4AFE
Label Count Molecule
Protein (1 molecule)
1
Serine/threonine-protein Kinase Nek2
(Gene symbol: NEK2)
Molecule annotation
Chemicals and Non-standard biopolymers (2 molecules)
1
1
4-(2-AMINO-5-{4-[(DIMETHYLAMINO)METHYL]THIOPHEN-2-YL}PYRIDIN-3-YL)-2-{[(1R,2Z)-4,4,4-TRIFLUORO-1-METHYLBUT-2-EN-1-YL]OXY}BENZAMIDE4-(2-AMINO-5-{4-[(DIMETHYLAMINO)METHYL]THIOPHEN-2-YL}PYRIDIN-3-YL)-2-{[(1R,2Z)-4,4,4-TRIFLUORO-1-METHYLBUT-2-EN-1-YL]OXY}BENZAMIDE
2
1
1,2-ETHANEDIOL1,2-ETHANEDIOL
* 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