6TX5
CRYSTAL STRUCTURE OF HUMAN FKBP51 FK1 DOMAIN A19T MUTANT IN COMPLEX WITH 4-METHYLIMIDAZOLE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X06SA |
| Synchrotron site | SLS |
| Beamline | X06SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2015-10-03 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 0.700490 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 42.206, 54.323, 56.652 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 33.850 - 1.080 |
| R-factor | 0.1223 |
| Rwork | 0.122 |
| R-free | 0.13920 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3o5q |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.057 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 54.320 | 1.088 |
| High resolution limit [Å] | 1.080 | 1.084 |
| Rmerge | 0.038 | 0.745 |
| Rpim | 0.016 | 0.016 |
| Number of reflections | 55652 | 562 |
| <I/σ(I)> | 21.6 | 2.1 |
| Completeness [%] | 99.6 | 100 |
| Redundancy | 6.5 | 6.4 |
| CC(1/2) | 1.000 | 0.700 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 7.5 | 293.15 | 28-41% PEG3350, 0.2M NH4OAc, 0.1M HEPES |
