8W1L
Structure of CSF1R kinase domain in complex with Cpd 32
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 22-ID |
Synchrotron site | APS |
Beamline | 22-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-04-15 |
Detector | MAR CCD 300 mm |
Wavelength(s) | 1.0 |
Spacegroup name | H 3 |
Unit cell lengths | 81.020, 81.020, 146.060 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 32.390 - 2.260 |
R-factor | 0.1776 |
Rwork | 0.172 |
R-free | 0.22550 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.010 |
RMSD bond angle | 0.971 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX (1.20.1_4487) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 32.390 | 2.343 |
High resolution limit [Å] | 2.260 | 2.260 |
Number of reflections | 15788 | 1378 |
<I/σ(I)> | 25.7 | |
Completeness [%] | 94.5 | 82.8 |
Redundancy | 2.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 293 | 0.1 M MES, pH 6.5, 21.3% polyethylene glycol 3350 and 0.25 M ammonium sulfate |