8A21
Crystal structure of Phosphoserine phosphatase SerB from Mycobacterium avium in complex with phenylimidazole
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SOLEIL BEAMLINE PROXIMA 1 |
Synchrotron site | SOLEIL |
Beamline | PROXIMA 1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-06-01 |
Detector | DECTRIS EIGER X 16M |
Wavelength(s) | 0.9786 |
Spacegroup name | I 2 2 2 |
Unit cell lengths | 65.570, 109.740, 133.970 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 43.090 - 2.180 |
R-factor | 0.211 |
Rwork | 0.206 |
R-free | 0.27050 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3p96 |
Data reduction software | XDS |
Data scaling software | XSCALE |
Phasing software | PHASER |
Refinement software | PHENIX (1.19.2_4158) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 43.090 | 2.260 |
High resolution limit [Å] | 2.180 | 2.180 |
Rmerge | 0.112 | 1.531 |
Rmeas | 0.116 | |
Rpim | 0.032 | 0.460 |
Number of reflections | 25224 | 2238 |
<I/σ(I)> | 16.22 | 1.51 |
Completeness [%] | 98.8 | 87.94 |
Redundancy | 13.3 | 11.6 |
CC(1/2) | 0.999 | 0.777 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.1 | 290 | MgCl2 0,5M; 20%PEG6000 MES 0.1M pH6.1 |