5V1B
Structure of PHD1 in complex with 1,2,4-Triazolo-[1,5-a]pyridine
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SLS BEAMLINE X10SA |
| Synchrotron site | SLS |
| Beamline | X10SA |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2014-05-15 |
| Detector | ADSC QUANTUM 4 |
| Wavelength(s) | 1.0 |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 66.717, 112.082, 66.223 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 43.340 - 2.490 |
| R-factor | 0.1917 |
| Rwork | 0.189 |
| R-free | 0.23630 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.302 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
| Overall | |
| Low resolution limit [Å] | 50.000 |
| High resolution limit [Å] | 2.490 |
| Rmerge | 0.100 |
| Rmeas | 0.110 |
| Rpim | 0.045 |
| Total number of observations | 34505 |
| Number of reflections | 8476 |
| <I/σ(I)> | 7.3 |
| Completeness [%] | 96.6 |
| Redundancy | 5.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 273 | 28% PEG 3350, Bis-Tris 7 |
