9VLJ
Crystal structure of FGFR1 in complex with covalent inhibitor 10a
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL02U1 |
| Synchrotron site | SSRF |
| Beamline | BL02U1 |
| Temperature [K] | 80 |
| Detector technology | CCD |
| Collection date | 2024-04-13 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97918 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 211.440, 49.710, 66.840 |
| Unit cell angles | 90.00, 107.75, 90.00 |
Refinement procedure
| Resolution | 31.600 - 1.810 |
| R-factor | 0.1781 |
| Rwork | 0.176 |
| R-free | 0.21460 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.051 |
| Data reduction software | xia2 |
| Data scaling software | xia2 |
| Phasing software | PHENIX |
| Refinement software | PHENIX ((1.19.2_4158: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 36.990 | 1.875 |
| High resolution limit [Å] | 1.810 | 1.810 |
| Rmerge | 0.160 | 1.640 |
| Number of reflections | 60085 | 28223 |
| <I/σ(I)> | 10.05 | 1.75 |
| Completeness [%] | 99.0 | 98.13 |
| Redundancy | 6.3 | 4.8 |
| CC(1/2) | 0.996 | 0.453 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 277.15 | 18% (w/v) PEG 8000, 0.2 M Li2SO4, and 0.1 M MES, pH 6.5 |
