5G4J
Phospholyase A1RDF1 from Arthrobacter in complex with phosphoethanolamine
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | DIAMOND BEAMLINE I02 |
Synchrotron site | Diamond |
Beamline | I02 |
Temperature [K] | 120 |
Detector technology | PIXEL |
Collection date | 2016-04-18 |
Detector | DECTRIS PILATUS 6M |
Spacegroup name | P 21 21 21 |
Unit cell lengths | 76.166, 96.371, 121.897 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 75.600 - 1.870 |
R-factor | 0.16884 |
Rwork | 0.167 |
R-free | 0.19943 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5g4i |
RMSD bond length | 0.021 |
RMSD bond angle | 1.915 |
Data reduction software | XDS |
Data scaling software | SCALA |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0135) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 64.590 | 1.950 |
High resolution limit [Å] | 1.870 | 1.870 |
Rmerge | 0.080 | 0.670 |
Number of reflections | 74689 | |
<I/σ(I)> | 14.5 | 2.6 |
Completeness [%] | 99.8 | 99.9 |
Redundancy | 6.5 | 6.8 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | 6 | 24% (W/V) PEG 3350, 0.2 M (NH4)2SO4 AND 3% (V/V) 2-METHYL-2,4-PENTANEDIOL IN 0.1 M BIS-TRIS PROPANE BUFFER AT PH 6.0 |