5XA5
Crystal structure of HMP-1-HMP-2 complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL12-2 |
Synchrotron site | SSRL |
Beamline | BL12-2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2012-07-30 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 1.006 |
Spacegroup name | P 31 2 1 |
Unit cell lengths | 57.095, 57.095, 155.436 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 28.547 - 1.600 |
R-factor | 0.1912 |
Rwork | 0.190 |
R-free | 0.22280 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.007 |
RMSD bond angle | 0.967 |
Data reduction software | XDS |
Data scaling software | SCALA (3.3.16) |
Phasing software | PHASER |
Refinement software | PHENIX ((phenix.refine: dev_1760)) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 38.859 | 38.859 | 1.660 |
High resolution limit [Å] | 1.577 | 4.990 | 1.580 |
Rmerge | 0.021 | 0.555 | |
Rmeas | 0.033 | 0.023 | 0.627 |
Rpim | 0.014 | 0.010 | 0.286 |
Number of reflections | 40755 | ||
<I/σ(I)> | 23.4 | 20.4 | 1.4 |
Completeness [%] | 98.4 | 99.2 | 90.3 |
Redundancy | 5.2 | 4.8 | 4.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 298 | 0.1M citrate pH 5.6, 0.2M lithium sulfate, 20% PEG 3350 |