6RNR
The crystal structure of a complex between the LlFpg protein, a THF-DNA and an inhibitor
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE MASSIF-3 |
Synchrotron site | ESRF |
Beamline | MASSIF-3 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2016-07-11 |
Detector | DECTRIS EIGER X 4M |
Wavelength(s) | 0.96770 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 91.813, 91.813, 141.617 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 45.907 - 2.003 |
R-factor | 0.175 |
Rwork | 0.174 |
R-free | 0.19500 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 1pm5 |
RMSD bond length | 0.008 |
RMSD bond angle | 0.979 |
Data reduction software | XDS |
Data scaling software | autoPROC |
Phasing software | PHASER |
Refinement software | PHENIX (1.10.1_2155) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 47.210 | 2.040 |
High resolution limit [Å] | 2.000 | 2.000 |
Rmerge | 0.056 | |
Number of reflections | 41111 | 2048 |
<I/σ(I)> | 18.7 | 2.1 |
Completeness [%] | 98.8 | 99.9 |
Redundancy | 7.1 | |
CC(1/2) | 0.999 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 293 | HEPES, CITRATE |