6RV0
human Alanine:Glyoxylate Aminotransferase major allele (AGT-Ma); with PMP in the active site
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | ESRF BEAMLINE ID23-1 |
Synchrotron site | ESRF |
Beamline | ID23-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2018-07-28 |
Detector | DECTRIS PILATUS 6M-F |
Wavelength(s) | 0.9762 |
Spacegroup name | P 41 21 2 |
Unit cell lengths | 90.306, 90.306, 142.071 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 47.490 - 2.700 |
R-factor | 0.2623 |
Rwork | 0.260 |
R-free | 0.32530 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 5f9s |
RMSD bond length | 0.006 |
RMSD bond angle | 1.463 |
Data reduction software | XDS |
Data scaling software | Aimless (0.7.4) |
Phasing software | MOLREP |
Refinement software | REFMAC (5.8.0238) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 47.490 | 47.490 | 2.830 |
High resolution limit [Å] | 2.700 | 8.960 | 2.700 |
Rmerge | 0.069 | 0.029 | 1.120 |
Rmeas | 0.074 | 0.031 | 1.193 |
Rpim | 0.025 | 0.011 | 0.402 |
Total number of observations | 141538 | 3868 | 18516 |
Number of reflections | 16712 | 524 | 2202 |
<I/σ(I)> | 15.8 | 49.4 | 1.9 |
Completeness [%] | 99.5 | 97 | 100 |
Redundancy | 8.5 | 7.4 | 8.4 |
CC(1/2) | 0.999 | 0.999 | 0.734 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 294 | 10-12% PEG 6K; 5% 2-methyl-2,4-pentanediol (MPD); 0.1M MES pH 6.5 |