4DD2
EVAL processed HEWL, carboplatin aqueous glycerol
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 |
Temperature [K] | 100 |
Detector technology | IMAGE PLATE |
Collection date | 2010-03-02 |
Detector | RIGAKU RAXIS IV |
Wavelength(s) | 1.5418 |
Spacegroup name | P 43 21 2 |
Unit cell lengths | 78.906, 78.906, 36.998 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 19.730 - 1.550 |
R-factor | 0.20244 |
Rwork | 0.200 |
R-free | 0.24505 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 2w1y |
RMSD bond length | 0.019 |
RMSD bond angle | 2.072 |
Data reduction software | EVAL15 (15) |
Data scaling software | EVAL15 (15) |
Phasing software | PHASER (MR) |
Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 19.730 | 1.600 |
High resolution limit [Å] | 1.550 | 1.550 |
Rmerge | 0.063 | 0.456 |
Number of reflections | 13707 | |
<I/σ(I)> | 30.1 | 2.1 |
Completeness [%] | 94.7 | 94.9 |
Redundancy | 18.8 | 4.2 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | BATCH | 4.7 | 295 | HEWL co-crystallized with carboplatin in 1 mL 0.05 M sodium acetate buffer and 1 mL 10% sodium chloride aqueous media, pH 4.7, BATCH, temperature 295K |