9D9D
Candida albicans Hsp90 nucleotide binding domain in complex with BRI2216
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SEALED TUBE |
| Source details | RIGAKU MICROMAX-003 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-06-09 |
| Detector | DECTRIS EIGER R 1M |
| Wavelength(s) | 1.542 |
| Spacegroup name | P 43 |
| Unit cell lengths | 74.041, 74.041, 108.811 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 28.290 - 2.090 |
| R-factor | 0.2207 |
| Rwork | 0.218 |
| R-free | 0.26670 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.034 |
| Data reduction software | CrysalisPro |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX (1.21.1_5286) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.300 | 2.080 |
| High resolution limit [Å] | 2.030 | 2.030 |
| Rmerge | 0.123 | 1.040 |
| Rmeas | 0.131 | 1.145 |
| Rpim | 0.045 | 0.469 |
| Total number of observations | 320744 | 16461 |
| Number of reflections | 37948 | 2797 |
| <I/σ(I)> | 15.2 | 1.7 |
| Completeness [%] | 100.0 | |
| Redundancy | 8.5 | 5.9 |
| CC(1/2) | 0.998 | 0.520 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 277 | 21% PEG6000, 0.1M Cacodylates pH 6.6, 0.2 M Ca Acetate, 20% glycerol |
