7FAI
CARM1 bound with compound 9
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U1 |
| Synchrotron site | SSRF |
| Beamline | BL17U1 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2017-11-22 |
| Detector | ADSC QUANTUM 315r |
| Wavelength(s) | 0.97915 |
| Spacegroup name | P 21 21 2 |
| Unit cell lengths | 74.819, 98.600, 205.969 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 60.530 - 2.097 |
| R-factor | 0.196190884764 |
| Rwork | 0.194 |
| R-free | 0.23169 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6izq |
| RMSD bond length | 0.007 |
| RMSD bond angle | 0.900 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX |
| Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 60.531 | 2.150 |
| High resolution limit [Å] | 2.097 | 2.100 |
| Rmerge | 0.611 | 0.143 |
| Number of reflections | 89925 | 89925 |
| <I/σ(I)> | 10.6 | |
| Completeness [%] | 99.8 | |
| Redundancy | 13.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 298 | 22-27% PEG 3350, 0.15M sodium malate, pH 7.0 |
