7WOK
Crystal structure of HSA soaked with cisplatin for one week
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRF BEAMLINE BL17U |
| Synchrotron site | SSRF |
| Beamline | BL17U |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2011-05-26 |
| Detector | ADSC QUANTUM 315 |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 58.376, 180.518, 58.503 |
| Unit cell angles | 90.00, 103.87, 90.00 |
Refinement procedure
| Resolution | 36.550 - 2.900 |
| R-factor | 0.2084 |
| Rwork | 0.207 |
| R-free | 0.24440 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1ao6 |
| RMSD bond length | 0.010 |
| RMSD bond angle | 1.369 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | BALBES |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 3.000 |
| High resolution limit [Å] | 2.900 | 2.900 |
| Rmerge | 0.086 | 1.500 |
| Number of reflections | 25610 | 2520 |
| <I/σ(I)> | 24.8 | 1.52 |
| Completeness [%] | 99.7 | 100 |
| Redundancy | 7.5 | |
| CC(1/2) | 0.999 | 0.667 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 297 | 26-32% PEG 3350, 50mM PB at pH 7.5 |
