9O1T
Heparanase P6 in complex with fragment J13
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 | 2021-03-27 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.9537 |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 59.222, 76.010, 126.263 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 46.720 - 1.900 |
| R-factor | 0.1864 |
| Rwork | 0.185 |
| R-free | 0.21580 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.008 |
| RMSD bond angle | 0.896 |
| 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] | 48.560 | 1.940 |
| High resolution limit [Å] | 1.900 | 1.900 |
| Rmerge | 0.154 | 6.870 |
| Rmeas | 0.160 | 7.160 |
| Rpim | 0.043 | 2.003 |
| Total number of observations | 620191 | 36672 |
| Number of reflections | 45762 | 2895 |
| <I/σ(I)> | 12.8 | 0.8 |
| Completeness [%] | 100.0 | |
| Redundancy | 13.6 | 12.7 |
| CC(1/2) | 0.999 | 0.570 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | 0.2 M Ammonium sulfate, 0.1 M ammoniuma acetate, 25% PEG 4000 |
