4JKV: Structure of the human smoothened 7TM receptor in complex with an antitumor agent

PDB ID: 4JKVDownload
MMDB ID: 109459
PDB Deposition Date: 2013/3/11
Updated in MMDB: 2017/11
Experimental Method:
x-ray diffraction
Resolution: 2.45  Å
Source Organism:
Similar Structures:
Biological Unit for 4JKV: dimeric; determined by author and by software (PISA)
Molecular Components in 4JKV
Label Count Molecule
Proteins (2 molecules)
2
Soluble Cytochrome B562, Smoothened Homolog
(Gene symbol: SMO)
Molecule annotation
Chemicals and Non-standard biopolymers (14 molecules)
1
2
4-fluoro-N-methyl-N-{1-[4-(1-methyl-1H-pyrazol-5-yl)phthalazin-1-yl]piperidin-4-yl}-2-(trifluoromethyl)benzamide4-fluoro-N-methyl-N-{1-[4-(1-methyl-1H-pyrazol-5-yl)phthalazin-1-yl]piperidin-4-yl}-2-(trifluoromethyl)benzamide
2
5
(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate(2R)-2,3-dihydroxypropyl (9Z)-octadec-9-enoate
3
3
OLEIC ACIDOLEIC ACID
4
2
DI(HYDROXYETHYL)ETHERDI(HYDROXYETHYL)ETHER
5
1
TRIETHYLENE GLYCOLTRIETHYLENE GLYCOL
6
1
TETRAETHYLENE GLYCOLTETRAETHYLENE GLYCOL
* 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