9BFB
Crystal structure of BRAF kinase domain with PF-07284890
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU FR-E |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2019-03-11 |
Detector | DECTRIS EIGER R 1M |
Wavelength(s) | 1.54 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 97.609, 97.609, 69.311 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 29.020 - 1.920 |
R-factor | 0.1656 |
Rwork | 0.164 |
R-free | 0.18880 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.008 |
RMSD bond angle | 0.937 |
Data reduction software | DENZO |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 29.020 | 1.970 |
High resolution limit [Å] | 1.920 | 1.920 |
Rmerge | 0.077 | 0.566 |
Rmeas | 0.081 | 0.609 |
Rpim | 0.027 | 0.220 |
Number of reflections | 29350 | 1965 |
<I/σ(I)> | 17.6 | 3 |
Completeness [%] | 99.8 | 99.8 |
Redundancy | 9 | 7.4 |
CC(1/2) | 0.999 | 0.878 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7 | 293 | 100mM Hepes pH 7.0, 15 % PEG 8K, 10% Tacsimate |