9HN6
X-ray structure of the adduct formed upon reaction of the diiodido analogue of picoplatin with ribonuclease A
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 11.2C |
| Synchrotron site | ELETTRA |
| Beamline | 11.2C |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2020-12-05 |
| Detector | DECTRIS PILATUS 6M |
| Wavelength(s) | 1.00 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 100.040, 32.640, 73.450 |
| Unit cell angles | 90.00, 90.11, 90.00 |
Refinement procedure
| Resolution | 73.450 - 1.770 |
| Rwork | 0.208 |
| R-free | 0.27610 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.009 |
| RMSD bond angle | 1.680 |
| Data reduction software | autoPROC |
| Data scaling software | autoPROC |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 73.450 | 1.800 |
| High resolution limit [Å] | 1.770 | 1.770 |
| Rmerge | 0.077 | 0.881 |
| Rmeas | 0.085 | 0.966 |
| Rpim | 0.035 | 0.393 |
| Number of reflections | 23489 | 6936 |
| <I/σ(I)> | 12 | 2.4 |
| Completeness [%] | 99.7 | 100 |
| Redundancy | 5.7 | 5.9 |
| CC(1/2) | 0.997 | 0.860 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 5.1 | 293 | 20% PEG4000, and 0.1 M sodium citrate pH 5.1 |
