9O2L
Heparanase P6 in complex with fragment C17
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | AUSTRALIAN SYNCHROTRON BEAMLINE MX2 |
| Synchrotron site | Australian Synchrotron |
| Beamline | MX2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-08-11 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 58.566, 74.948, 124.768 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 47.950 - 1.900 |
| R-factor | 0.1963 |
| Rwork | 0.195 |
| R-free | 0.23160 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 0.816 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.21.2_5419: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 47.950 | 1.940 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.422 | 7.350 |
| Rmeas | 0.439 | 7.664 |
| Rpim | 0.120 | 2.147 |
| Total number of observations | 591567 | 37287 |
| Number of reflections | 44134 | 2824 |
| <I/σ(I)> | 6.3 | 0.8 |
| Completeness [%] | 100.0 | |
| Redundancy | 13.4 | 13.2 |
| CC(1/2) | 0.993 | 0.675 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5 | 297 | 0.2 M ammonium sulfate, 0.1 M ammonium acetate, 25% PEG4000 |
