6FUH
Complement factor D in complex with the inhibitor (4-((3-(aminomethyl)phenyl)amino)quinazolin-2-yl)-L-valine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SLS BEAMLINE X10SA |
Synchrotron site | SLS |
Beamline | X10SA |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2008-01-05 |
Detector | DECTRIS PILATUS 2M |
Wavelength(s) | 1.00 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 55.516, 49.321, 39.198 |
Unit cell angles | 90.00, 106.16, 90.00 |
Refinement procedure
Resolution | 25.340 - 1.370 |
R-factor | 0.13626 |
Rwork | 0.134 |
R-free | 0.17962 |
RMSD bond length | 0.032 |
RMSD bond angle | 2.652 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0189) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 26.660 | 1.420 |
High resolution limit [Å] | 1.370 | 1.370 |
Number of reflections | 40221 | |
<I/σ(I)> | 14.11 | |
Completeness [%] | 93.7 | |
Redundancy | 2.79 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 293 | 25% PEG3350, 100 mM TRIS pH 8.5, 200 mM NH4SO2, 2 mM inhibitor |