8ZVV
human citrate synthase complexed with citrate
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL10U2 |
| Synchrotron site | SSRF |
| Beamline | BL10U2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2023-12-15 |
| Detector | DECTRIS EIGER X 16M |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 57.548, 194.332, 69.369 |
| Unit cell angles | 90.00, 90.40, 90.00 |
Refinement procedure
| Resolution | 97.170 - 1.590 |
| R-factor | 0.24419 |
| Rwork | 0.241 |
| R-free | 0.29543 |
| Structure solution method | MOLECULAR REPLACEMENT |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.413 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0411) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 97.170 | 1.680 |
| High resolution limit [Å] | 1.590 | 1.590 |
| Rmerge | 0.134 | 1.272 |
| Rmeas | 0.150 | 1.456 |
| Number of reflections | 201557 | 28976 |
| <I/σ(I)> | 6.5 | |
| Completeness [%] | 99.1 | |
| Redundancy | 4.8 | |
| CC(1/2) | 0.987 | 0.323 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 289.15 | 0.2 M ammonium acetate pH=7.1, 20% w/v PEG3350 |
