6VGC
Crystal Structures of FLAP bound to DG-031
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 31-ID |
Synchrotron site | APS |
Beamline | 31-ID |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-05-21 |
Detector | RAYONIX MX-225 |
Wavelength(s) | 0.9793 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 65.911, 101.488, 111.864 |
Unit cell angles | 90.00, 99.83, 90.00 |
Refinement procedure
Resolution | 30.000 - 2.370 |
R-factor | 0.2554 |
Rwork | 0.254 |
R-free | 0.28480 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2q7m |
RMSD bond length | 0.006 |
RMSD bond angle | 0.817 |
Data reduction software | MOSFLM |
Data scaling software | SCALA |
Phasing software | PHASER |
Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 101.490 | 2.500 |
High resolution limit [Å] | 2.370 | 2.370 |
Number of reflections | 54437 | 3982 |
<I/σ(I)> | 16.4 | |
Completeness [%] | 98.0 | 97 |
Redundancy | 3.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 6.5 | 298 | 100 mM MES pH 6.5, 26% PEG 350 MME, 200 mM Calcium Chloride, 1 mM DG-031 |