5QT9
T. brucei FPPS in complex with CID 23155989
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 | 2017-03-26 |
Detector | DECTRIS PILATUS3 6M |
Wavelength(s) | 0.999970 |
Spacegroup name | P 61 2 2 |
Unit cell lengths | 60.929, 60.929, 343.320 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 52.766 - 2.199 |
R-factor | 0.2318 |
Rwork | 0.230 |
R-free | 0.27420 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | pdbid 4ryp |
Data reduction software | XDS (20180808) |
Data scaling software | Aimless (0.7.4) |
Phasing software | PHASER (2.8.2) |
Refinement software | PHENIX (1.14_3260) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 52.766 | 2.475 |
High resolution limit [Å] | 2.199 | 2.199 |
Rmerge | 0.125 | 1.543 |
Rmeas | 0.172 | 7.189 |
Rpim | 0.040 | 1.598 |
Total number of observations | 299421 | 46150 |
Number of reflections | 12144 | 2347 |
<I/σ(I)> | 16.3 | 0.6 |
Completeness [%] | 59.4 | 10.3 |
Redundancy | 17.9 | 16 |
CC(1/2) | 0.999 | 0.553 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 6 | 293 | 0.12 M CsCl 12 % w/v PEG 3350, 6 % v/v xylitol |