4YI7
Anthranilate bound at active site of anthranilate phosphoribosyl transferase from Acinetobacter (AnPRT; TrpD)
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | ROTATING ANODE |
Source details | RIGAKU MICROMAX-007 HF |
Temperature [K] | 110 |
Detector technology | IMAGE PLATE |
Collection date | 2014-12-08 |
Detector | MAR scanner 345 mm plate |
Wavelength(s) | 1.54179 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 60.997, 70.830, 169.156 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 42.289 - 1.853 |
R-factor | 0.2247 |
Rwork | 0.223 |
R-free | 0.25770 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 4gtn |
RMSD bond length | 0.007 |
RMSD bond angle | 0.936 |
Data reduction software | XDS |
Data scaling software | XDS |
Phasing software | PHASER ((phaser_mr: 2.5.6)) |
Refinement software | PHENIX ((phenix.refine: 1.9_1692)) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 45.000 | 1.910 |
High resolution limit [Å] | 1.850 | 1.850 |
Rmerge | 0.025 | 0.402 |
Number of reflections | 31276 | |
<I/σ(I)> | 28.7 | 2.7 |
Completeness [%] | 99.9 | 99 |
Redundancy | 7.2 | 6.9 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.96 | 291.15 | PEG 8000, sodium cacodylate, magnesium acetate |