2YEI: HSP90 inhibitors and drugs from fragment and virtual screening

PDB ID: 2YEIDownload
MMDB ID: 91735
PDB Deposition Date: 2011/3/25
Updated in MMDB: 2023/12
Experimental Method:
x-ray diffraction
Resolution: 2.2  Å
Source Organism:
Similar Structures:
Biological Unit for 2YEI: monomeric; determined by author and by software (PISA)
Molecular Components in 2YEI
Label Count Molecule
Protein (1 molecule)
1
Heat Shock Protein HSP 90-alpha
(Gene symbol: HSP90AA1)
Molecule annotation
Chemicals and Non-standard biopolymers (2 molecules)
1
1
METHYL 5-ISOXAZOL-5-YL-3-METHYL-1H-PYRAZOLE-4-CARBOXYLATEMETHYL 5-ISOXAZOL-5-YL-3-METHYL-1H-PYRAZOLE-4-CARBOXYLATE
2
1
METHYL 2-(3,5-DIHYDROXYPHENYL)ETHANOATEMETHYL 2-(3,5-DIHYDROXYPHENYL)ETHANOATE
* 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