5HW8
Candida albicans FKBP12 P104G protein bound with FK506 in C2 space group
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 22-BM |
| Synchrotron site | APS |
| Beamline | 22-BM |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2012-06-10 |
| Detector | MAR CCD 130 mm |
| Wavelength(s) | 1 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 115.423, 84.184, 116.724 |
| Unit cell angles | 90.00, 109.81, 90.00 |
Refinement procedure
| Resolution | 26.148 - 2.860 |
| R-factor | 0.2473 |
| Rwork | 0.244 |
| R-free | 0.28530 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.586 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.8.4_1496) |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 50.000 | 50.000 | 2.640 |
| High resolution limit [Å] | 2.600 | 7.050 | 2.600 |
| Rmerge | 0.124 | 0.094 | 0.387 |
| Number of reflections | 27492 | ||
| <I/σ(I)> | 12.6 | ||
| Completeness [%] | 84.3 | 95.6 | 37.6 |
| Redundancy | 2.8 | 3.1 | 1.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 1M Na Citrate, 0.2M NaCl and 0.1M Tris-HCl pH 7.0 |
