6YF0
FKBP12 in complex with the BMP potentiator compound 9 at 1.55 A resolution
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2017-02-04 |
| Detector | PSI PILATUS 6M |
| Wavelength(s) | 0.99996 |
| Spacegroup name | P 61 2 2 |
| Unit cell lengths | 62.338, 62.338, 135.408 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 19.540 - 1.550 |
| R-factor | 0.2378 |
| Rwork | 0.237 |
| R-free | 0.25710 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 4dh0 |
| RMSD bond length | 0.007 |
| RMSD bond angle | 1.107 |
| Data reduction software | XDS |
| Data scaling software | XSCALE |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0032) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 19.540 | 1.590 |
| High resolution limit [Å] | 1.550 | 1.550 |
| Rmerge | 0.038 | 1.058 |
| Rmeas | 0.040 | 1.086 |
| Rpim | 0.917 | |
| Number of reflections | 23333 | 1596 |
| <I/σ(I)> | 43.6 | 3.6 |
| Completeness [%] | 99.7 | 100 |
| Redundancy | 18.8 | 19.7 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 298 | 2.2 M AmSO4, 0.2 M NaThiocyanate |
