9WGO
Crystal structure of OcKAI2d2 from Orobanche cumana covalently bound to KOK1094
This is a non-PDB format compatible entry.
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SOLEIL BEAMLINE PROXIMA 1 |
| Synchrotron site | SOLEIL |
| Beamline | PROXIMA 1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2024-02-18 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.987 |
| Spacegroup name | P 64 2 2 |
| Unit cell lengths | 149.300, 149.300, 57.270 |
| Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
| Resolution | 48.920 - 2.350 |
| R-factor | 0.2214 |
| Rwork | 0.218 |
| R-free | 0.24856 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | MOLREP |
| Refinement software | REFMAC (refmac5) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 48.920 | 2.430 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Number of reflections | 16088 | 1504 |
| <I/σ(I)> | 12.3 | |
| Completeness [%] | 99.5 | 96.97 |
| Redundancy | 20 | |
| CC(1/2) | 0.990 | 0.470 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 298 | 1.8 M Sodium phosphate monobasic monohydrate, Potassium phosphate dibasic, pH 6.9 |
