6DAQ
PhdJ bound to substrate intermediate
Experimental procedure
Experimental method | LAUE |
Source type | SYNCHROTRON |
Source details | ALS BEAMLINE 5.0.3 |
Synchrotron site | ALS |
Beamline | 5.0.3 |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2015-08-25 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.99-1.5 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 52.532, 137.200, 88.270 |
Unit cell angles | 90.00, 98.91, 90.00 |
Refinement procedure
Resolution | 45.290 - 2.000 |
R-factor | 0.161 |
Rwork | 0.160 |
R-free | 0.19400 |
RMSD bond length | 0.004 |
RMSD bond angle | 0.667 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | PHASER |
Refinement software | PHENIX ((1.11.1_2575: ???)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 2.070 |
High resolution limit [Å] | 2.000 | 2.000 |
Number of reflections | 77204 | |
<I/σ(I)> | 14 | |
Completeness [%] | 93.5 | |
Redundancy | 3.6 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 7 | 298.15 | 0.1 M MES at pH 7-7.5 and 22-25% in PEG 3350 |