6LON
Crystal structure of HPSG
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL18U1 |
Synchrotron site | SSRF |
Beamline | BL18U1 |
Temperature [K] | 193.15 |
Detector technology | PIXEL |
Collection date | 2019-06-13 |
Detector | DECTRIS PILATUS3 R CdTe 300K |
Wavelength(s) | 0.9792 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 92.917, 219.401, 213.141 |
Unit cell angles | 90.00, 98.04, 90.00 |
Refinement procedure
Resolution | 36.248 - 2.200 |
R-factor | 0.143 |
Rwork | 0.143 |
R-free | 0.17900 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5ymr |
RMSD bond length | 0.011 |
RMSD bond angle | 1.087 |
Data reduction software | HKL-3000 |
Data scaling software | HKL-2000 |
Phasing software | PHENIX |
Refinement software | PHENIX (1.11.1_2575) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 50.000 | 50.000 | 2.240 |
High resolution limit [Å] | 2.198 | 5.970 | 2.200 |
Rmerge | 0.086 | 0.033 | 0.442 |
Rmeas | 0.102 | 0.039 | 0.525 |
Rpim | 0.055 | 0.021 | 0.281 |
Number of reflections | 213322 | 10759 | 10633 |
<I/σ(I)> | 3.7 | ||
Completeness [%] | 99.9 | 99.6 | 99.9 |
Redundancy | 3.4 | 3.4 | 3.4 |
CC(1/2) | 0.998 | 0.794 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 291.15 | 0.2M sodium acetate, 0.1M Bis-Tris propane, pH 6.5, 16% (w/v) PEG 3350, 500mM DHPS |