8J8E
Human serum albumin-palladium(II) agent complex
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRF BEAMLINE BL02U1 |
Synchrotron site | SSRF |
Beamline | BL02U1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2023-01-05 |
Detector | DECTRIS EIGER2 S 9M |
Wavelength(s) | 0.987 |
Spacegroup name | P 1 |
Unit cell lengths | 38.356, 92.706, 95.345 |
Unit cell angles | 74.89, 89.73, 79.88 |
Refinement procedure
Resolution | 91.960 - 2.500 |
R-factor | 0.2531 |
Rwork | 0.250 |
R-free | 0.31619 |
Structure solution method | MOLECULAR REPLACEMENT |
RMSD bond length | 0.011 |
RMSD bond angle | 1.527 |
Data reduction software | HKL-3000 (7.21) |
Data scaling software | DIALS |
Phasing software | PHASER (2.7.0) |
Refinement software | REFMAC (5.8.0158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 91.960 | 2.560 |
High resolution limit [Å] | 2.500 | 2.500 |
Rmerge | 0.177 | 0.177 |
Number of reflections | 42319 | 3143 |
<I/σ(I)> | 4.1 | |
Completeness [%] | 98.1 | |
Redundancy | 3.3 | 3.5 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 298 | 30% PEG 3350, 0.05M PB 7.0, 5% G, 5% DMSO |