6Y1U
Mycobacterium tuberculosis FtsZ-GDP in complex with 4-hydroxycoumarin
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I04-1 |
Synchrotron site | Diamond |
Beamline | I04-1 |
Temperature [K] | 298.15 |
Detector technology | PIXEL |
Collection date | 2019-04-05 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9159 |
Spacegroup name | P 65 |
Unit cell lengths | 88.130, 88.130, 176.783 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 76.320 - 1.680 |
R-factor | 0.1698 |
Rwork | 0.168 |
R-free | 0.19660 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1rq7 |
RMSD bond length | 0.012 |
RMSD bond angle | 1.216 |
Data reduction software | iMOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | PHENIX (1.16_3549) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 76.323 | 1.740 |
High resolution limit [Å] | 1.680 | 1.680 |
Number of reflections | 88000 | 8733 |
<I/σ(I)> | 17.5 | |
Completeness [%] | 100.0 | |
Redundancy | 8 | |
CC(1/2) | 0.999 | 0.479 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.6 | 291.15 | 27.5% PEG4000, 0.4 M ammonium acetate and 0.1 M Na citrate, soaked with 37.5 mM of inhibitor |